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Filtered Search Results
Lanosterol, TRC
CAS: 79-63-0 Molecular Formula: C30 H50 O Molecular Weight (g/mol): 426.72 Synonym: Lanosta-8,24-dien-3-ol, (3β)- (9CI, ACI),(3β)-Lanosta-8,24-dien-3-ol (ACI),Lanosta-8,24-dien-3β-ol (8CI),Lanostadien-3β-ol (7CI),Lanosterol (6CI),3β-Hydroxy-lansota-8,24-dien-21-oic acid,3β-Hydroxylanosta-8,24-diene,4,4,14α-Trimethylcholesta-8,24-dien-3β-ol,5α-Lanosta-8,24-dien-3β-ol,Lanosta-8,24-dienol,Lanosterin,Lanster,MeSH ID: D007810,NSC 60677 IUPAC Name: (3S,5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol SMILES: C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC3
| CAS | 79-63-0 |
|---|---|
| Molecular Weight (g/mol) | 426.72 |
| SMILES | C[C@H](CCC=C(C)C)[C@H]1CC[C@@]2(C)C3=C(CC[C@]12C)[C@@]4(C)CC[C@H](O)C(C)(C)[C@@H]4CC3 |
| Synonym | Lanosta-8,24-dien-3-ol, (3β)- (9CI, ACI),(3β)-Lanosta-8,24-dien-3-ol (ACI),Lanosta-8,24-dien-3β-ol (8CI),Lanostadien-3β-ol (7CI),Lanosterol (6CI),3β-Hydroxy-lansota-8,24-dien-21-oic acid,3β-Hydroxylanosta-8,24-diene,4,4,14α-Trimethylcholesta-8,24-dien-3β-ol,5α-Lanosta-8,24-dien-3β-ol,Lanosta-8,24-dienol,Lanosterin,Lanster,MeSH ID: D007810,NSC 60677 |
| IUPAC Name | (3S,5R,10S,13R,14R,17R)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,7,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol |
| Molecular Formula | C30 H50 O |
Lupeol, TRC
CAS: 545-47-1 Molecular Formula: C30 H50 O Molecular Weight (g/mol): 426.72 IUPAC Name: (1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol SMILES: CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12
| CAS | 545-47-1 |
|---|---|
| Molecular Weight (g/mol) | 426.72 |
| SMILES | CC(=C)[C@@H]1CC[C@]2(C)CC[C@]3(C)[C@H](CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]12 |
| IUPAC Name | (1R,3aR,5aR,5bR,7aR,9S,11aR,11bR,13aR,13bR)-3a,5a,5b,8,8,11a-hexamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysen-9-ol |
| Molecular Formula | C30 H50 O |
Celastrol, TRC
CAS: 34157-83-0 Molecular Formula: C29 H38 O4 Molecular Weight (g/mol): 450.61 Synonym: 24,25,26-Trinoroleana-1(10),3,5,7-tetraen-29-oic acid, 3-hydroxy-9,13-dimethyl-2-oxo-, (9β,13α,14β,20α)-,24-Nor-D:A-friedooleana-1(10),3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo- (7CI,8CI),D:A-Friedo-24-noroleana-1(10),3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo-, (20α)-,(9β,13α,14β,20α)-3-Hydroxy-9,13-dimethyl-2-oxo-24,25,26-trinoroleana-1(10),3,5,7-tetraen-29-oic acid,2-Picenecarboxylic acid, 1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydro-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-, (2R,4aS,6aS,12bR,14aS,14bR)-,2-Picenecarboxylic acid, 1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydro-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-, [2R-(2α,4aβ,6aβ,12bβ,14aα,14bβ)]-,Celastrol,NSC 70931,Tripterin IUPAC Name: (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid SMILES: C[C@@]12[C@]([C@@]3([H])[C@@](CC1)(CC[C@](C)(C3)C(O)=O)C)(CC[C@@]4(C2=CC=C5C4=CC(C(O)=C5C)=O)C)C
| CAS | 34157-83-0 |
|---|---|
| Molecular Weight (g/mol) | 450.61 |
| SMILES | C[C@@]12[C@]([C@@]3([H])[C@@](CC1)(CC[C@](C)(C3)C(O)=O)C)(CC[C@@]4(C2=CC=C5C4=CC(C(O)=C5C)=O)C)C |
| Synonym | 24,25,26-Trinoroleana-1(10),3,5,7-tetraen-29-oic acid, 3-hydroxy-9,13-dimethyl-2-oxo-, (9β,13α,14β,20α)-,24-Nor-D:A-friedooleana-1(10),3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo- (7CI,8CI),D:A-Friedo-24-noroleana-1(10),3,5,7-tetraen-29-oic acid, 3-hydroxy-2-oxo-, (20α)-,(9β,13α,14β,20α)-3-Hydroxy-9,13-dimethyl-2-oxo-24,25,26-trinoroleana-1(10),3,5,7-tetraen-29-oic acid,2-Picenecarboxylic acid, 1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydro-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-, (2R,4aS,6aS,12bR,14aS,14bR)-,2-Picenecarboxylic acid, 1,2,3,4,4a,5,6,6a,11,12b,13,14,14a,14b-tetradecahydro-10-hydroxy-2,4a,6a,9,12b,14a-hexamethyl-11-oxo-, [2R-(2α,4aβ,6aβ,12bβ,14aα,14bβ)]-,Celastrol,NSC 70931,Tripterin |
| IUPAC Name | (2R,4aS,6aR,6aS,14aS,14bR)-10-hydroxy-2,4a,6a,6a,9,14a-hexamethyl-11-oxo-1,3,4,5,6,13,14,14b-octahydropicene-2-carboxylic acid |
| Molecular Formula | C29 H38 O4 |
Azadirachtin, TRC
CAS: 11141-17-6 Molecular Formula: C35 H44 O16 Molecular Weight (g/mol): 720.72 Synonym: Azadirachtin,Azadirachtin A,1H,7H-Naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3,5-dihydroxy-4-methyl-8-[[(2E)-2-methyl-1-oxo-2-buten-1-yl]oxy]-4-[(1aR,2S,3aS,6aS,7S,7aS)-3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl]-, 5,10a-dimethyl ester, (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)-,1H,7H-Naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3,5-dihydroxy-4-methyl-8-[(2-methyl-1-oxo-2-butenyl)oxy]-4-(3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-, dimethyl ester, [2aR-[2aα,3β,4β(1aR*,2S*,3aS*,6aS*,7S*,7aS*),4aβ,5α,7aS*,8β(E),10β,10aα,10bβ]]-,1H,7H-Naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3,5-dihydroxy-4-methyl-8-[[(2E)-2-methyl-1-oxo-2-butenyl]oxy]-4-[(1aR,2S,3aS,6aS,7S,7aS)-3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl]-, dimethyl ester, (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)- (9CI),2,7-Methanofuro[2,3-b]oxireno[e]oxepin, 1H,7H-naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid deriv.,Align,AzaMax,Azatin,Azatin EC,Azatin Magnum,Azatin XL,BioNEEM,Biosal,Ecozin,Gronim,Molt-X,NeemAzal,NeemAzal F,NeemAzal T,NeemAzal T/S,NeemAzal W,Neemazol,Neemgold,Neemseto,Nimbecidine,Nimbecidine EC,Nimbicidine,Nimurin,Oikos,Oikos 25 plus,Oikos 323 Bio,Ornazin,Pestoneem,Safer BioNEEM,Suneem,Superneem,2,7-Methanofuro[2,3-b]oxireno[e]oxepin, 1H,7H-naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid deriv.,Align,AzaMax,Azadirachtin,Azadirachtin A,Azatin,Azatin EC,Azatin Magnum,Azatin XL,BioNEEM,Biosal,Ecozin,Gronim,NeemAzal,NeemAzal F,NeemAzal T,NeemAzal T/S,NeemAzal W,Neemazol,Neemgold,Nimbicidine,Nimurin,Oikos,Oikos 25 plus,Oikos 323 Bio,Ornazin,Safer BioNEEM,Suneem,Superneem IUPAC Name: dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-acetoxy-4,7-dihydroxy-6-[(2S,6S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.0^{2,6}.0^{9,11}]dodec-3-en-9-yl]-6-methyl-14-[(E)-2-methylbut-2-enoyl]oxy-3,9-dioxatetracyclo[6.6.1.0^{1,5}.0^{11,15}]pentadecane-4,11-dicarboxylate SMILES: COC(=O)[C@@]1(O)OC[C@@]23[C@H](C[C@@H](OC(=O)C)[C@]4(CO[C@@H]([C@@H](O)[C@](C)([C@H]12)[C@]56O[C@@]5(C)[C@H]7C[C@@H]6O[C@@H]8OC=C[C@]78O)[C@H]34)C(=O)OC)OC(=O)\C(=C\C)\C
| CAS | 11141-17-6 |
|---|---|
| Molecular Weight (g/mol) | 720.72 |
| SMILES | COC(=O)[C@@]1(O)OC[C@@]23[C@H](C[C@@H](OC(=O)C)[C@]4(CO[C@@H]([C@@H](O)[C@](C)([C@H]12)[C@]56O[C@@]5(C)[C@H]7C[C@@H]6O[C@@H]8OC=C[C@]78O)[C@H]34)C(=O)OC)OC(=O)\C(=C\C)\C |
| Synonym | Azadirachtin,Azadirachtin A,1H,7H-Naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3,5-dihydroxy-4-methyl-8-[[(2E)-2-methyl-1-oxo-2-buten-1-yl]oxy]-4-[(1aR,2S,3aS,6aS,7S,7aS)-3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl]-, 5,10a-dimethyl ester, (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)-,1H,7H-Naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3,5-dihydroxy-4-methyl-8-[(2-methyl-1-oxo-2-butenyl)oxy]-4-(3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl)-, dimethyl ester, [2aR-[2aα,3β,4β(1aR*,2S*,3aS*,6aS*,7S*,7aS*),4aβ,5α,7aS*,8β(E),10β,10aα,10bβ]]-,1H,7H-Naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid, 10-(acetyloxy)octahydro-3,5-dihydroxy-4-methyl-8-[[(2E)-2-methyl-1-oxo-2-butenyl]oxy]-4-[(1aR,2S,3aS,6aS,7S,7aS)-3a,6a,7,7a-tetrahydro-6a-hydroxy-7a-methyl-2,7-methanofuro[2,3-b]oxireno[e]oxepin-1a(2H)-yl]-, dimethyl ester, (2aR,3S,4S,4aR,5S,7aS,8S,10R,10aS,10bR)- (9CI),2,7-Methanofuro[2,3-b]oxireno[e]oxepin, 1H,7H-naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid deriv.,Align,AzaMax,Azatin,Azatin EC,Azatin Magnum,Azatin XL,BioNEEM,Biosal,Ecozin,Gronim,Molt-X,NeemAzal,NeemAzal F,NeemAzal T,NeemAzal T/S,NeemAzal W,Neemazol,Neemgold,Neemseto,Nimbecidine,Nimbecidine EC,Nimbicidine,Nimurin,Oikos,Oikos 25 plus,Oikos 323 Bio,Ornazin,Pestoneem,Safer BioNEEM,Suneem,Superneem,2,7-Methanofuro[2,3-b]oxireno[e]oxepin, 1H,7H-naphtho[1,8-bc:4,4a-c']difuran-5,10a(8H)-dicarboxylic acid deriv.,Align,AzaMax,Azadirachtin,Azadirachtin A,Azatin,Azatin EC,Azatin Magnum,Azatin XL,BioNEEM,Biosal,Ecozin,Gronim,NeemAzal,NeemAzal F,NeemAzal T,NeemAzal T/S,NeemAzal W,Neemazol,Neemgold,Nimbicidine,Nimurin,Oikos,Oikos 25 plus,Oikos 323 Bio,Ornazin,Safer BioNEEM,Suneem,Superneem |
| IUPAC Name | dimethyl (1S,4S,5R,6S,7S,8R,11S,12R,14S,15R)-12-acetoxy-4,7-dihydroxy-6-[(2S,6S,9R,11S)-2-hydroxy-11-methyl-5,7,10-trioxatetracyclo[6.3.1.0^{2,6}.0^{9,11}]dodec-3-en-9-yl]-6-methyl-14-[(E)-2-methylbut-2-enoyl]oxy-3,9-dioxatetracyclo[6.6.1.0^{1,5}.0^{11,15}]pentadecane-4,11-dicarboxylate |
| Molecular Formula | C35 H44 O16 |
Friedelin, TRC
CAS: 559-74-0 Molecular Formula: C30 H50 O Molecular Weight (g/mol): 426.72 Synonym: 24,25,26-Trinoroleanan-3-one, 5,9,13-trimethyl-, (4β,5β,8α,9β,10α,13α,14β)-,D:A-Friedooleanan-3-one (8CI),Friedelin (6CI),(-)-Friedelin,(4β,5β,8α,9β,10α,13α,14β)-5,9,13-Trimethyl-24,25,26-trinoroleanan-3-one,3(2H)-Picenone, eicosahydro-4,4a,6b,8a,11,11,12b,14a-octamethyl-, (4R,4aS,6aS,6bR,8aR,12aR,12bS,14aS,14bS)-,3(2H)-Picenone, eicosahydro-4,4a,6b,8a,11,11,12b,14a-octamethyl-, [4R-(4α,4aα,6aβ,6bα,8aα,12aα,12bβ,14aα,14bβ)]-,3-Oxofriedelane,Friedelan-3-one,Friedelanone,Friedeline,NSC 55141 IUPAC Name: (4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one SMILES: C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]3[C@@]2(C)CC[C@@]4(C)[C@@H]5CC(C)(C)CC[C@]5(C)CC[C@]34C
| CAS | 559-74-0 |
|---|---|
| Molecular Weight (g/mol) | 426.72 |
| SMILES | C[C@H]1C(=O)CC[C@@H]2[C@]1(C)CC[C@H]3[C@@]2(C)CC[C@@]4(C)[C@@H]5CC(C)(C)CC[C@]5(C)CC[C@]34C |
| Synonym | 24,25,26-Trinoroleanan-3-one, 5,9,13-trimethyl-, (4β,5β,8α,9β,10α,13α,14β)-,D:A-Friedooleanan-3-one (8CI),Friedelin (6CI),(-)-Friedelin,(4β,5β,8α,9β,10α,13α,14β)-5,9,13-Trimethyl-24,25,26-trinoroleanan-3-one,3(2H)-Picenone, eicosahydro-4,4a,6b,8a,11,11,12b,14a-octamethyl-, (4R,4aS,6aS,6bR,8aR,12aR,12bS,14aS,14bS)-,3(2H)-Picenone, eicosahydro-4,4a,6b,8a,11,11,12b,14a-octamethyl-, [4R-(4α,4aα,6aβ,6bα,8aα,12aα,12bβ,14aα,14bβ)]-,3-Oxofriedelane,Friedelan-3-one,Friedelanone,Friedeline,NSC 55141 |
| IUPAC Name | (4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one |
| Molecular Formula | C30 H50 O |
Epoxyazadiradione, TRC
CAS: 18385-59-6 Molecular Formula: C28 H34 O6 Molecular Weight (g/mol): 466.56 Synonym: Nimbinin,14,15-Epoxy-14H-cyclopenta[a]phenanthrene, 24-norchola-1,20,22-triene-3,16-dione deriv.,Azadiradione 14β,15β-Epoxide SMILES: CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](C(=O)[C@H]5O[C@@]45[C@]13C)c6cocc6
| CAS | 18385-59-6 |
|---|---|
| Molecular Weight (g/mol) | 466.56 |
| SMILES | CC(=O)O[C@@H]1C[C@H]2C(C)(C)C(=O)C=C[C@]2(C)[C@H]3CC[C@@]4(C)[C@@H](C(=O)[C@H]5O[C@@]45[C@]13C)c6cocc6 |
| Synonym | Nimbinin,14,15-Epoxy-14H-cyclopenta[a]phenanthrene, 24-norchola-1,20,22-triene-3,16-dione deriv.,Azadiradione 14β,15β-Epoxide |
| Molecular Formula | C28 H34 O6 |
Epifriedelanol, TRC
CAS: 16844-71-6 Molecular Formula: C30H52O Molecular Weight (g/mol): 428.73 Synonym: (3β)-D:A-Friedooleanan-3-ol,D:A-Friedooleanan-3β-ol,3-Epifriedelinol,3-epi-Friedanol,3β-Hydroxyfriedelane,Epifriedelanol,Epifriedelinol,Friedelan-3β-ol,Friedelin-3β-ol,Longan Triterpane A,epi-Friedelanol,β-Friedelinol IUPAC Name: (3S,4R,4aS,6bR,8aR,12aR,12bS,14aS,14bS)-4,4a,6b,8a,11,11,12b,14a-octamethyldocosahydropicen-3-ol SMILES: [H][C@@]12[C@@](CCC(C)(C)C2)(C)CC[C@]3(C)C4CC[C@]5(C)[C@@H](C)[C@@H](O)CC[C@@]5([H])[C@]4(C)CC[C@]31C
| CAS | 16844-71-6 |
|---|---|
| Molecular Weight (g/mol) | 428.73 |
| SMILES | [H][C@@]12[C@@](CCC(C)(C)C2)(C)CC[C@]3(C)C4CC[C@]5(C)[C@@H](C)[C@@H](O)CC[C@@]5([H])[C@]4(C)CC[C@]31C |
| Synonym | (3β)-D:A-Friedooleanan-3-ol,D:A-Friedooleanan-3β-ol,3-Epifriedelinol,3-epi-Friedanol,3β-Hydroxyfriedelane,Epifriedelanol,Epifriedelinol,Friedelan-3β-ol,Friedelin-3β-ol,Longan Triterpane A,epi-Friedelanol,β-Friedelinol |
| IUPAC Name | (3S,4R,4aS,6bR,8aR,12aR,12bS,14aS,14bS)-4,4a,6b,8a,11,11,12b,14a-octamethyldocosahydropicen-3-ol |
| Molecular Formula | C30H52O |
Alpha-Hederin, TRC
CAS: 27013-91-8 Molecular Formula: C41 H66 O12 Molecular Weight (g/mol): 750.96 Synonym: Olean-12-en-28-oic acid, 3-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-23-hydroxy-, (3β,4α)-,α-Hederin (7CI,8CI),(+)-Dipsacobioside,(3β,4α)-3-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-23-hydroxyolean-12-en-28-oic acid,23-Hydroxy-3β-[(O-α-L-rhamnopyranosyl-(1→2)-α-L-arabinopyranosyl)oxy]olean-12-en-28-oic acid,3-O-α-L-Rhamnopyranosyl-(1→2)-α-L-arabinopyranosylhederagenin,Akebia saponin PD,Akeboside Stc,Cephalaroside C,Dipsacobioside,Dipsacoside A,Dipsacus saponin L,Glycoside L-E1,Hederagenin 3-O-α-L-rhamnopyranosyl-(1 → 2)-α-L-arabinopyranoside,Hederoside C,Helixin,Kalopanaxsaponin A,Kizuta saponin K6,Koronaroside A,NSC 106553,Nepalin 2,Prosapogenin CP3b,Pulsatilla saponin A,Sapindoside A,Tauroside E IUPAC Name: (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid SMILES: C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C6[C@@H]7CC(C)(C)CC[C@@]7(CC[C@@]56C)C(=O)O)[C@]3(C)CO)[C@H](O)[C@H](O)[C@H]1O
| CAS | 27013-91-8 |
|---|---|
| Molecular Weight (g/mol) | 750.96 |
| SMILES | C[C@@H]1O[C@@H](O[C@@H]2[C@@H](O)[C@@H](O)CO[C@H]2O[C@H]3CC[C@@]4(C)[C@@H](CC[C@]5(C)[C@@H]4CC=C6[C@@H]7CC(C)(C)CC[C@@]7(CC[C@@]56C)C(=O)O)[C@]3(C)CO)[C@H](O)[C@H](O)[C@H]1O |
| Synonym | Olean-12-en-28-oic acid, 3-[[2-O-(6-deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-23-hydroxy-, (3β,4α)-,α-Hederin (7CI,8CI),(+)-Dipsacobioside,(3β,4α)-3-[[2-O-(6-Deoxy-α-L-mannopyranosyl)-α-L-arabinopyranosyl]oxy]-23-hydroxyolean-12-en-28-oic acid,23-Hydroxy-3β-[(O-α-L-rhamnopyranosyl-(1→2)-α-L-arabinopyranosyl)oxy]olean-12-en-28-oic acid,3-O-α-L-Rhamnopyranosyl-(1→2)-α-L-arabinopyranosylhederagenin,Akebia saponin PD,Akeboside Stc,Cephalaroside C,Dipsacobioside,Dipsacoside A,Dipsacus saponin L,Glycoside L-E1,Hederagenin 3-O-α-L-rhamnopyranosyl-(1 → 2)-α-L-arabinopyranoside,Hederoside C,Helixin,Kalopanaxsaponin A,Kizuta saponin K6,Koronaroside A,NSC 106553,Nepalin 2,Prosapogenin CP3b,Pulsatilla saponin A,Sapindoside A,Tauroside E |
| IUPAC Name | (4aS,6aR,6aS,6bR,8aR,9R,10S,12aR,14bS)-10-[(2S,3R,4S,5S)-4,5-dihydroxy-3-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Molecular Formula | C41 H66 O12 |
Toosendanin, TRC
CAS: 58812-37-6 Molecular Formula: C30 H38 O11 Molecular Weight (g/mol): 574.62 Synonym: [C(R),1α,3α,4β,5α,7α,12α,13α,14β,15β,17α]-3,12-Bis(acetyloxy)-14,15:21,23-diepoxy-1,7,19-trihydroxy-4,8-dimethyl-11-oxo-24-Norchola-20,22-diene-4-carboxaldehyde Cyclic 4,19-Hemiacetal,14,15-Epoxy-4,10-(methanoxymethano)-1H-cyclopenta[a]phenanthrene, 24-Norchola-20,22-diene-4-carboxaldehyde Deriv.,28-Deacetylsendanin,Chuanliansu SMILES: CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]4(C)[C@@H]3C(=O)[C@H](OC(=O)C)[C@@]5(C)[C@@H](C[C@H]6O[C@@]456)c7cocc7
| CAS | 58812-37-6 |
|---|---|
| Molecular Weight (g/mol) | 574.62 |
| SMILES | CC(=O)O[C@@H]1C[C@H](O)[C@@]23CO[C@@H](O)[C@]1(C)[C@@H]2C[C@@H](O)[C@]4(C)[C@@H]3C(=O)[C@H](OC(=O)C)[C@@]5(C)[C@@H](C[C@H]6O[C@@]456)c7cocc7 |
| Synonym | [C(R),1α,3α,4β,5α,7α,12α,13α,14β,15β,17α]-3,12-Bis(acetyloxy)-14,15:21,23-diepoxy-1,7,19-trihydroxy-4,8-dimethyl-11-oxo-24-Norchola-20,22-diene-4-carboxaldehyde Cyclic 4,19-Hemiacetal,14,15-Epoxy-4,10-(methanoxymethano)-1H-cyclopenta[a]phenanthrene, 24-Norchola-20,22-diene-4-carboxaldehyde Deriv.,28-Deacetylsendanin,Chuanliansu |
| Molecular Formula | C30 H38 O11 |
Tigogenin, TRC
CAS: 77-60-1 Molecular Formula: C27H44O3 Molecular Weight (g/mol): 416.64 Synonym: 5α-Spirostan-3β-ol,(25R)-5α-Spirostan-3β-ol,Tigogenin,(25R)-5α-Spirostan-3β-ol,NSC 93754,Ticogenin,(3β,5α,25R)-Spirostan-3-ol SMILES: C[C@@H]1CC[C@@]2(OC1)O[C@H]3C[C@H]4[C@@H]5CC[C@H]6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2C
| CAS | 77-60-1 |
|---|---|
| Molecular Weight (g/mol) | 416.64 |
| SMILES | C[C@@H]1CC[C@@]2(OC1)O[C@H]3C[C@H]4[C@@H]5CC[C@H]6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2C |
| Synonym | 5α-Spirostan-3β-ol,(25R)-5α-Spirostan-3β-ol,Tigogenin,(25R)-5α-Spirostan-3β-ol,NSC 93754,Ticogenin,(3β,5α,25R)-Spirostan-3-ol |
| Molecular Formula | C27H44O3 |
Diosgenin, TRC
CAS: 512-04-9 Molecular Formula: C27 H42 O3 Molecular Weight (g/mol): 414.62 Synonym: Spirost-5-en-3-ol, (3β,25R)-,25D-Spirost-5-en-3β-ol (6CI,7CI),Spirost-5-en-3β-ol, (25R)- (8CI),Spiro[8H-naphth[2',1':4,5]indeno[2,1-b]furan-8,2'-[2H]pyran], spirost-5-en-3-ol deriv.,(25R)-Spirost-5-en-3β-ol,(3β,25R)-Spirost-5-en-3-ol,25α-Spirost-5-en-3β-ol,Diosgenin,NSC 33396,Nitogenin SMILES: C[C@@H]1CC[C@@]2(OC1)O[C@H]3C[C@H]4[C@@H]5CC=C6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2C
| CAS | 512-04-9 |
|---|---|
| Molecular Weight (g/mol) | 414.62 |
| SMILES | C[C@@H]1CC[C@@]2(OC1)O[C@H]3C[C@H]4[C@@H]5CC=C6C[C@@H](O)CC[C@]6(C)[C@H]5CC[C@]4(C)[C@H]3[C@@H]2C |
| Synonym | Spirost-5-en-3-ol, (3β,25R)-,25D-Spirost-5-en-3β-ol (6CI,7CI),Spirost-5-en-3β-ol, (25R)- (8CI),Spiro[8H-naphth[2',1':4,5]indeno[2,1-b]furan-8,2'-[2H]pyran], spirost-5-en-3-ol deriv.,(25R)-Spirost-5-en-3β-ol,(3β,25R)-Spirost-5-en-3-ol,25α-Spirost-5-en-3β-ol,Diosgenin,NSC 33396,Nitogenin |
| Molecular Formula | C27 H42 O3 |
Bayogenin, TRC
CAS: 6989-24-8 Molecular Formula: C30H48O5 Molecular Weight (g/mol): 488.7 Synonym: Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (2β,3β,4α)-,Olean-12-en-28-oic acid, 2β,3β,23-trihydroxy- (7CI,8CI),2β,3β,23α-Trihydroxy-12-oleanen-28-oic acid,Bayogenin,Bayogenine IUPAC Name: (4aS,6aR,6aS,6bR,8aR,9R,10R,11S,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid SMILES: CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)O
| CAS | 6989-24-8 |
|---|---|
| Molecular Weight (g/mol) | 488.7 |
| SMILES | CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)O |
| Synonym | Olean-12-en-28-oic acid, 2,3,23-trihydroxy-, (2β,3β,4α)-,Olean-12-en-28-oic acid, 2β,3β,23-trihydroxy- (7CI,8CI),2β,3β,23α-Trihydroxy-12-oleanen-28-oic acid,Bayogenin,Bayogenine |
| IUPAC Name | (4aS,6aR,6aS,6bR,8aR,9R,10R,11S,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2,2,6a,6b,9,12a-hexamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Molecular Formula | C30H48O5 |
Uvaol, TRC
CAS: 545-46-0 Molecular Formula: C30 H50 O2 Molecular Weight (g/mol): 442.72 Synonym: (3β)-Urs-12-ene-3,28-diol,3,28-Dixydroxyurs-12-ene,3β,28-Dihydroxyurs-12-ene,Uvalol IUPAC Name: (3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol SMILES: C[C@@H]1CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C
| CAS | 545-46-0 |
|---|---|
| Molecular Weight (g/mol) | 442.72 |
| SMILES | C[C@@H]1CC[C@]2(CO)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C |
| Synonym | (3β)-Urs-12-ene-3,28-diol,3,28-Dixydroxyurs-12-ene,3β,28-Dihydroxyurs-12-ene,Uvalol |
| IUPAC Name | (3S,4aR,6aR,6bS,8aS,11R,12S,12aS,14aR,14bR)-8a-(hydroxymethyl)-4,4,6a,6b,11,12,14b-heptamethyl-2,3,4a,5,6,7,8,9,10,11,12,12a,14,14a-tetradecahydro-1H-picen-3-ol |
| Molecular Formula | C30 H50 O2 |
Phytolaccagenin, TRC
CAS: 1802-12-6 Molecular Formula: C31H48O7 Molecular Weight (g/mol): 532.71 Synonym: Olean-12-ene-28,30-dioic acid, 2beta,3beta,23-trihydroxy-, 30-methyl ester (8CI),Phytolaccagenin (7CI),Jaligonic acid 30-methyl ester,NSC 116453,Olean-12-ene-28,29-dioic acid, 2,3,23-trihydroxy-, 29-methyl ester, (2beta,3beta,4alpha,20beta)- IUPAC Name: (2S,4aR,6aR,6aS,6bR,8aR,9R,10R,11S,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2-methoxycarbonyl-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid SMILES: COC(=O)[C@@]1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)O
| CAS | 1802-12-6 |
|---|---|
| Molecular Weight (g/mol) | 532.71 |
| SMILES | COC(=O)[C@@]1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)C[C@H](O)[C@H](O)[C@@](C)(CO)[C@@H]5CC[C@@]34C)[C@@H]2C1)C(=O)O |
| Synonym | Olean-12-ene-28,30-dioic acid, 2beta,3beta,23-trihydroxy-, 30-methyl ester (8CI),Phytolaccagenin (7CI),Jaligonic acid 30-methyl ester,NSC 116453,Olean-12-ene-28,29-dioic acid, 2,3,23-trihydroxy-, 29-methyl ester, (2beta,3beta,4alpha,20beta)- |
| IUPAC Name | (2S,4aR,6aR,6aS,6bR,8aR,9R,10R,11S,12aR,14bS)-10,11-dihydroxy-9-(hydroxymethyl)-2-methoxycarbonyl-2,6a,6b,9,12a-pentamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid |
| Molecular Formula | C31H48O7 |
Nimbin, TRC
CAS: 5945-86-8 Molecular Formula: C30 H36 O9 Molecular Weight (g/mol): 540.6 Synonym: (4alpha,5alpha,6alpha,7alpha,15beta,17alpha)-6-(acetyloxy)-7,15:21,23-diepoxy-4,8-dimethyl-1-oxo-8,24-dinor-11,12-secochola-2,13,20,22-tetraene-4,11-dicarboxylic acid methyl ester,18,24-Dinor-11,12-secochola-2,13,20,22-tetraene-4,11-dicarboxylic acid, 6-(acetyloxy)-7,15:21,23-diepoxy-4,8-dimethyl-1-oxo-, dimethyl ester, (4α,5α,6α,7α,15β,17α)-,2H-Cyclopenta[b]naphtho[2,3-d]furan-10-acetic acid, 6α-carboxy-2α-(3-furyl)-3,3aα,4aβ,5,5aα,6,9,9a,10α,10a-decahydro-5α-hydroxy-1,6,9aβ,10aβ-tetramethyl-9-oxo-, dimethyl ester, acetate (8CI),2H-Cyclopenta[b]naphtho[2,3-d]furan-10-acetic acid, 6β-carboxy-2α-(3-furyl)-3,3aβ,4aβ,5,5aα,6,9,9a,10,10a-decahydro-5α-hydroxy-1,6,9aβ,10aβ-tetramethyl-9-oxo-, dimethyl ester, acetate (7CI),Nimbin (6CI),2H-Cyclopenta[b]naphtho[2,3-d]furan-10-acetic acid, 5-(acetyloxy)-2-(3-furanyl)-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-6-(methoxycarbonyl)-1,6,9a,10a-tetramethyl-9-oxo-, methyl ester, [2R-(2α,3aα,4aβ,5α,5aα,6α,9aβ,10β,10aβ)]- SMILES: COC(=O)C[C@@H]1[C@]2(C)[C@@H]([C@@H](OC(=O)C)[C@@H]3O[C@@H]4C[C@H](C(=C4[C@@]13C)C)c5cocc5)[C@](C)(OC(=O)C)C=CC2=O
| CAS | 5945-86-8 |
|---|---|
| Molecular Weight (g/mol) | 540.6 |
| SMILES | COC(=O)C[C@@H]1[C@]2(C)[C@@H]([C@@H](OC(=O)C)[C@@H]3O[C@@H]4C[C@H](C(=C4[C@@]13C)C)c5cocc5)[C@](C)(OC(=O)C)C=CC2=O |
| Synonym | (4alpha,5alpha,6alpha,7alpha,15beta,17alpha)-6-(acetyloxy)-7,15:21,23-diepoxy-4,8-dimethyl-1-oxo-8,24-dinor-11,12-secochola-2,13,20,22-tetraene-4,11-dicarboxylic acid methyl ester,18,24-Dinor-11,12-secochola-2,13,20,22-tetraene-4,11-dicarboxylic acid, 6-(acetyloxy)-7,15:21,23-diepoxy-4,8-dimethyl-1-oxo-, dimethyl ester, (4α,5α,6α,7α,15β,17α)-,2H-Cyclopenta[b]naphtho[2,3-d]furan-10-acetic acid, 6α-carboxy-2α-(3-furyl)-3,3aα,4aβ,5,5aα,6,9,9a,10α,10a-decahydro-5α-hydroxy-1,6,9aβ,10aβ-tetramethyl-9-oxo-, dimethyl ester, acetate (8CI),2H-Cyclopenta[b]naphtho[2,3-d]furan-10-acetic acid, 6β-carboxy-2α-(3-furyl)-3,3aβ,4aβ,5,5aα,6,9,9a,10,10a-decahydro-5α-hydroxy-1,6,9aβ,10aβ-tetramethyl-9-oxo-, dimethyl ester, acetate (7CI),Nimbin (6CI),2H-Cyclopenta[b]naphtho[2,3-d]furan-10-acetic acid, 5-(acetyloxy)-2-(3-furanyl)-3,3a,4a,5,5a,6,9,9a,10,10a-decahydro-6-(methoxycarbonyl)-1,6,9a,10a-tetramethyl-9-oxo-, methyl ester, [2R-(2α,3aα,4aβ,5α,5aα,6α,9aβ,10β,10aβ)]- |
| Molecular Formula | C30 H36 O9 |