Lipids and Lipid Derivatives
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Methyl palmitate, 99%, analytical standard for GC
CAS: 112-39-0 Molecular Formula: C17H34O2 Molecular Weight (g/mol): 270.45 InChI Key: FLIACVVOZYBSBS-UHFFFAOYSA-N Synonym: methyl palmitate,palmitic acid methyl ester,hexadecanoic acid, methyl ester,palmitic acid, methyl ester,uniphat a60,metholene 2216,methyl n-hexadecanoate,hexadecanoic acid methyl ester,n-hexadecanoic acid methyl ester,unii-dpy8vcm98i PubChem CID: 8181 ChEBI: CHEBI:69187 IUPAC Name: methyl hexadecanoate SMILES: CCCCCCCCCCCCCCCC(=O)OC
| PubChem CID | 8181 |
|---|---|
| CAS | 112-39-0 |
| Molecular Weight (g/mol) | 270.45 |
| ChEBI | CHEBI:69187 |
| SMILES | CCCCCCCCCCCCCCCC(=O)OC |
| Synonym | methyl palmitate,palmitic acid methyl ester,hexadecanoic acid, methyl ester,palmitic acid, methyl ester,uniphat a60,metholene 2216,methyl n-hexadecanoate,hexadecanoic acid methyl ester,n-hexadecanoic acid methyl ester,unii-dpy8vcm98i |
| IUPAC Name | methyl hexadecanoate |
| InChI Key | FLIACVVOZYBSBS-UHFFFAOYSA-N |
| Molecular Formula | C17H34O2 |
Thermo Scientific Chemicals Palmitic acid, 98%
CAS: 57-10-3 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00002747 InChI Key: IPCSVZSSVZVIGE-UHFFFAOYSA-N Synonym: palmitic acid,cetylic acid,palmitate,n-hexadecanoic acid,hexadecylic acid,hydrofol,n-hexadecoic acid,1-pentadecanecarboxylic acid,palmitinic acid,pentadecanecarboxylic acid PubChem CID: 985 ChEBI: CHEBI:15756 IUPAC Name: hexadecanoic acid SMILES: CCCCCCCCCCCCCCCC(O)=O
| PubChem CID | 985 |
|---|---|
| CAS | 57-10-3 |
| Molecular Weight (g/mol) | 256.43 |
| ChEBI | CHEBI:15756 |
| MDL Number | MFCD00002747 |
| SMILES | CCCCCCCCCCCCCCCC(O)=O |
| Synonym | palmitic acid,cetylic acid,palmitate,n-hexadecanoic acid,hexadecylic acid,hydrofol,n-hexadecoic acid,1-pentadecanecarboxylic acid,palmitinic acid,pentadecanecarboxylic acid |
| IUPAC Name | hexadecanoic acid |
| InChI Key | IPCSVZSSVZVIGE-UHFFFAOYSA-N |
| Molecular Formula | C16H32O2 |
Retinoic acid, 97%
CAS: 302-79-4 Molecular Formula: C20H28O2 Molecular Weight (g/mol): 300.44 MDL Number: MFCD00001551 InChI Key: SHGAZHPCJJPHSC-YCNIQYBTSA-N Synonym: retinoic acid,tretinoin,vitamin a acid,all-trans-retinoic acid,trans-retinoic acid,renova,airol,retin-a,vesanoid,atra PubChem CID: 444795 ChEBI: CHEBI:15367 SMILES: C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O
| PubChem CID | 444795 |
|---|---|
| CAS | 302-79-4 |
| Molecular Weight (g/mol) | 300.44 |
| ChEBI | CHEBI:15367 |
| MDL Number | MFCD00001551 |
| SMILES | C\C(\C=C\C1=C(C)CCCC1(C)C)=C/C=C/C(/C)=C/C(O)=O |
| Synonym | retinoic acid,tretinoin,vitamin a acid,all-trans-retinoic acid,trans-retinoic acid,renova,airol,retin-a,vesanoid,atra |
| InChI Key | SHGAZHPCJJPHSC-YCNIQYBTSA-N |
| Molecular Formula | C20H28O2 |
Thermo Scientific Chemicals Thymolphthalein
CAS: 125-20-2 Molecular Formula: C28H30O4 Molecular Weight (g/mol): 430.544 MDL Number: MFCD00005909 InChI Key: LDKDGDIWEUUXSH-UHFFFAOYSA-N Synonym: thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one PubChem CID: 31316 IUPAC Name: 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one SMILES: CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O
| PubChem CID | 31316 |
|---|---|
| CAS | 125-20-2 |
| Molecular Weight (g/mol) | 430.544 |
| MDL Number | MFCD00005909 |
| SMILES | CC1=CC(=C(C=C1C2(C3=CC=CC=C3C(=O)O2)C4=CC(=C(C=C4C)O)C(C)C)C(C)C)O |
| Synonym | thymolphthalein,thymophthalein,unii-yg5i28wsqp,yg5i28wsqp,phenolphthalein, 5',5-diisopropyl-2',2-dimethyl,3,3-bis 4-hydroxy-5-isopropyl-2-methylphenyl-2-benzofuran-1 3h-one,1 3h-isobenzofuranone, 3,3-bis 4-hydroxy-2-methyl-5-1-methylethyl phenyl,5',5-diisopropyl-2',2-dimethylphenolphthalein,3,3-bis 4-hydroxy-2-methyl-5-propan-2-ylphenyl-2-benzofuran-1-one |
| IUPAC Name | 3,3-bis(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-2-benzofuran-1-one |
| InChI Key | LDKDGDIWEUUXSH-UHFFFAOYSA-N |
| Molecular Formula | C28H30O4 |
Tributyrin, 97%
CAS: 60-01-5 Molecular Formula: C15H26O6 Molecular Weight (g/mol): 302.36 MDL Number: MFCD00009392 InChI Key: UYXTWWCETRIEDR-UHFFFAOYSA-N Synonym: tributyrin,glyceryl tributyrate,glycerol tributyrate,tributin,butyrin,butyryl triglyceride,propane-1,2,3-triyl tributyrate,glycerol tributanoate,glyceroltributyrin,tri-n-butyrin PubChem CID: 6050 ChEBI: CHEBI:35020 IUPAC Name: 2,3-di(butanoyloxy)propyl butanoate SMILES: CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC
| PubChem CID | 6050 |
|---|---|
| CAS | 60-01-5 |
| Molecular Weight (g/mol) | 302.36 |
| ChEBI | CHEBI:35020 |
| MDL Number | MFCD00009392 |
| SMILES | CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC |
| Synonym | tributyrin,glyceryl tributyrate,glycerol tributyrate,tributin,butyrin,butyryl triglyceride,propane-1,2,3-triyl tributyrate,glycerol tributanoate,glyceroltributyrin,tri-n-butyrin |
| IUPAC Name | 2,3-di(butanoyloxy)propyl butanoate |
| InChI Key | UYXTWWCETRIEDR-UHFFFAOYSA-N |
| Molecular Formula | C15H26O6 |
(-)-Terpinen-4-ol, 97%, sum of enantiomers
CAS: 20126-76-5 Molecular Formula: C10H18O Molecular Weight (g/mol): 154.25 MDL Number: MFCD00167108 InChI Key: WRYLYDPHFGVWKC-JTQLQIEISA-N Synonym: --terpinen-4-ol,--4-terpineol,unii-8vi196vs5t,p-menth-1-en-4-ol, r--,r-p-menth-1-en-4-ol,3-cyclohexen-1-ol, 4-methyl-1-1-methylethyl-, r,3-cyclohexen-1-ol, 4-methyl-1-1-methylethyl-, 1r,r-1-isopropyl-4-methyl-3-cyclohexen-1-ol,l-4-terpineneol,l-4-terpineol PubChem CID: 5325830 IUPAC Name: (1R)-4-methyl-1-propan-2-ylcyclohex-3-en-1-ol SMILES: CC1=CCC(CC1)(C(C)C)O
| PubChem CID | 5325830 |
|---|---|
| CAS | 20126-76-5 |
| Molecular Weight (g/mol) | 154.25 |
| MDL Number | MFCD00167108 |
| SMILES | CC1=CCC(CC1)(C(C)C)O |
| Synonym | --terpinen-4-ol,--4-terpineol,unii-8vi196vs5t,p-menth-1-en-4-ol, r--,r-p-menth-1-en-4-ol,3-cyclohexen-1-ol, 4-methyl-1-1-methylethyl-, r,3-cyclohexen-1-ol, 4-methyl-1-1-methylethyl-, 1r,r-1-isopropyl-4-methyl-3-cyclohexen-1-ol,l-4-terpineneol,l-4-terpineol |
| IUPAC Name | (1R)-4-methyl-1-propan-2-ylcyclohex-3-en-1-ol |
| InChI Key | WRYLYDPHFGVWKC-JTQLQIEISA-N |
| Molecular Formula | C10H18O |
(+/-)-2-Octanol, 98%
CAS: 123-96-6 Molecular Formula: C8H18O Molecular Weight (g/mol): 130.231 MDL Number: MFCD00004591 InChI Key: SJWFXCIHNDVPSH-UHFFFAOYSA-N Synonym: 2-octanol,2-octyl alcohol,hexylmethylcarbinol,2-hydroxyoctane,sec-caprylic alcohol,1-methylheptanol,methylhexylcarbinol,1-methylheptyl alcohol,dl-2-octanol,n-octan-2-ol PubChem CID: 20083 ChEBI: CHEBI:37869 IUPAC Name: octan-2-ol SMILES: CCCCCCC(C)O
| PubChem CID | 20083 |
|---|---|
| CAS | 123-96-6 |
| Molecular Weight (g/mol) | 130.231 |
| ChEBI | CHEBI:37869 |
| MDL Number | MFCD00004591 |
| SMILES | CCCCCCC(C)O |
| Synonym | 2-octanol,2-octyl alcohol,hexylmethylcarbinol,2-hydroxyoctane,sec-caprylic alcohol,1-methylheptanol,methylhexylcarbinol,1-methylheptyl alcohol,dl-2-octanol,n-octan-2-ol |
| IUPAC Name | octan-2-ol |
| InChI Key | SJWFXCIHNDVPSH-UHFFFAOYSA-N |
| Molecular Formula | C8H18O |
Thermo Scientific Chemicals Lauric acid, 99%
CAS: 143-07-7 Molecular Formula: C12H24O2 Molecular Weight (g/mol): 200.32 MDL Number: MFCD00002736 InChI Key: POULHZVOKOAJMA-UHFFFAOYSA-N Synonym: lauric acid,n-dodecanoic acid,dodecylic acid,vulvic acid,laurostearic acid,dodecoic acid,duodecylic acid,1-undecanecarboxylic acid,aliphat no. 4,neo-fat 12 PubChem CID: 3893 ChEBI: CHEBI:30805 IUPAC Name: dodecanoic acid SMILES: CCCCCCCCCCCC(=O)O
| PubChem CID | 3893 |
|---|---|
| CAS | 143-07-7 |
| Molecular Weight (g/mol) | 200.32 |
| ChEBI | CHEBI:30805 |
| MDL Number | MFCD00002736 |
| SMILES | CCCCCCCCCCCC(=O)O |
| Synonym | lauric acid,n-dodecanoic acid,dodecylic acid,vulvic acid,laurostearic acid,dodecoic acid,duodecylic acid,1-undecanecarboxylic acid,aliphat no. 4,neo-fat 12 |
| IUPAC Name | dodecanoic acid |
| InChI Key | POULHZVOKOAJMA-UHFFFAOYSA-N |
| Molecular Formula | C12H24O2 |
Sodium taurocholate hydrate, 96%
CAS: 345909-26-4 Molecular Formula: C26H44NNaO7S Molecular Weight (g/mol): 537.688 MDL Number: MFCD00150819 InChI Key: JAJWGJBVLPIOOH-VXFFEJGCSA-M Synonym: sodium taurocholate,taurocholic acid sodium salt,taurocholate sodium,taurocholate sodium salt,unii-m6n3th81no,monosodium n-choloyltaurinate,m6n3th81no,monosodium taurocholate,sodium n-choloyltaurinate,monosodium taurocholic acid PubChem CID: 131632374 IUPAC Name: sodium;2-[[(4R)-4-[(3R,5S,7R,8R,9R,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate SMILES: CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[Na+]
| PubChem CID | 131632374 |
|---|---|
| CAS | 345909-26-4 |
| Molecular Weight (g/mol) | 537.688 |
| MDL Number | MFCD00150819 |
| SMILES | CC(CCC(=O)NCCS(=O)(=O)[O-])C1CCC2C1(C(CC3C2C(CC4C3(CCC(C4)O)C)O)O)C.[Na+] |
| Synonym | sodium taurocholate,taurocholic acid sodium salt,taurocholate sodium,taurocholate sodium salt,unii-m6n3th81no,monosodium n-choloyltaurinate,m6n3th81no,monosodium taurocholate,sodium n-choloyltaurinate,monosodium taurocholic acid |
| IUPAC Name | sodium;2-[[(4R)-4-[(3R,5S,7R,8R,9R,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]ethanesulfonate |
| InChI Key | JAJWGJBVLPIOOH-VXFFEJGCSA-M |
| Molecular Formula | C26H44NNaO7S |
Sorbic acid, 99%
CAS: 110-44-1 Molecular Formula: C6H8O2 Molecular Weight (g/mol): 112.13 MDL Number: MFCD00002703 InChI Key: WSWCOQWTEOXDQX-MQQKCMAXSA-N Synonym: sorbic acid,2,4-hexadienoic acid,2e,4e-hexa-2,4-dienoic acid,2e,4e-hexadienoic acid,panosorb,2-propenylacrylic acid,trans,trans-sorbic acid,sorbistat,hexadienoic acid,e,e-2,4-hexadienoic acid PubChem CID: 643460 ChEBI: CHEBI:38358 IUPAC Name: (2E,4E)-hexa-2,4-dienoic acid SMILES: C\C=C\C=C\C(O)=O
| PubChem CID | 643460 |
|---|---|
| CAS | 110-44-1 |
| Molecular Weight (g/mol) | 112.13 |
| ChEBI | CHEBI:38358 |
| MDL Number | MFCD00002703 |
| SMILES | C\C=C\C=C\C(O)=O |
| Synonym | sorbic acid,2,4-hexadienoic acid,2e,4e-hexa-2,4-dienoic acid,2e,4e-hexadienoic acid,panosorb,2-propenylacrylic acid,trans,trans-sorbic acid,sorbistat,hexadienoic acid,e,e-2,4-hexadienoic acid |
| IUPAC Name | (2E,4E)-hexa-2,4-dienoic acid |
| InChI Key | WSWCOQWTEOXDQX-MQQKCMAXSA-N |
| Molecular Formula | C6H8O2 |
Methyl acetoacetate, 99+%
CAS: 105-45-3 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.12 MDL Number: MFCD00008784 InChI Key: WRQNANDWMGAFTP-UHFFFAOYSA-N Synonym: methyl acetoacetate,acetoacetic acid methyl ester,methylacetoacetate,methyl 3-oxobutyrate,butanoic acid, 3-oxo-, methyl ester,methyl acetylacetate,methyl acetylacetonate,3-oxobutanoic acid methyl ester,acetoacetic methyl ester,acetoacetic acid, methyl ester PubChem CID: 7757 IUPAC Name: methyl 3-oxobutanoate SMILES: COC(=O)CC(C)=O
| PubChem CID | 7757 |
|---|---|
| CAS | 105-45-3 |
| Molecular Weight (g/mol) | 116.12 |
| MDL Number | MFCD00008784 |
| SMILES | COC(=O)CC(C)=O |
| Synonym | methyl acetoacetate,acetoacetic acid methyl ester,methylacetoacetate,methyl 3-oxobutyrate,butanoic acid, 3-oxo-, methyl ester,methyl acetylacetate,methyl acetylacetonate,3-oxobutanoic acid methyl ester,acetoacetic methyl ester,acetoacetic acid, methyl ester |
| IUPAC Name | methyl 3-oxobutanoate |
| InChI Key | WRQNANDWMGAFTP-UHFFFAOYSA-N |
| Molecular Formula | C5H8O3 |
Methyl linolenate, 99%
CAS: 301-00-8 Molecular Formula: C19H32O2 Molecular Weight (g/mol): 292.46 MDL Number: MFCD00135851 InChI Key: DVWSXZIHSUZZKJ-YSTUJMKBSA-N Synonym: methyl linolenate,linolenic acid methyl ester,methyl alpha-linolenate,linolenic acid, methyl ester,unii-0s1ns923k6,alpha-linolenic acid methyl ester,methyl all-cis-9,12,15-octadecatrienoate,methyl 9z,12z,15z-octadeca-9,12,15-trienoate,9,12,15-octadecatrienoic acid, methyl ester, z,z,z,methyl cis,cis,cis-octadec-9,12,15-trienoate PubChem CID: 5319706 IUPAC Name: methyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate SMILES: CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)OC
| PubChem CID | 5319706 |
|---|---|
| CAS | 301-00-8 |
| Molecular Weight (g/mol) | 292.46 |
| MDL Number | MFCD00135851 |
| SMILES | CC\C=C/C\C=C/C\C=C/CCCCCCCC(=O)OC |
| Synonym | methyl linolenate,linolenic acid methyl ester,methyl alpha-linolenate,linolenic acid, methyl ester,unii-0s1ns923k6,alpha-linolenic acid methyl ester,methyl all-cis-9,12,15-octadecatrienoate,methyl 9z,12z,15z-octadeca-9,12,15-trienoate,9,12,15-octadecatrienoic acid, methyl ester, z,z,z,methyl cis,cis,cis-octadec-9,12,15-trienoate |
| IUPAC Name | methyl (9Z,12Z,15Z)-octadeca-9,12,15-trienoate |
| InChI Key | DVWSXZIHSUZZKJ-YSTUJMKBSA-N |
| Molecular Formula | C19H32O2 |
Citral, 95%, mixture of cis and trans
CAS: 5392-40-5 Molecular Formula: C10H16O Molecular Weight (g/mol): 152.24 MDL Number: MFCD00006997 InChI Key: WTEVQBCEXWBHNA-JXMROGBWSA-N Synonym: citral,geranial,trans-citral,3,7-dimethylocta-2,6-dienal,geranialdehyde,e-citral,citral a,2e-3,7-dimethylocta-2,6-dienal,alpha-citral,lemsyn gb PubChem CID: 638011 ChEBI: CHEBI:16980 IUPAC Name: (2E)-3,7-dimethylocta-2,6-dienal SMILES: CC(C)=CCC\C(C)=C\C=O
| PubChem CID | 638011 |
|---|---|
| CAS | 5392-40-5 |
| Molecular Weight (g/mol) | 152.24 |
| ChEBI | CHEBI:16980 |
| MDL Number | MFCD00006997 |
| SMILES | CC(C)=CCC\C(C)=C\C=O |
| Synonym | citral,geranial,trans-citral,3,7-dimethylocta-2,6-dienal,geranialdehyde,e-citral,citral a,2e-3,7-dimethylocta-2,6-dienal,alpha-citral,lemsyn gb |
| IUPAC Name | (2E)-3,7-dimethylocta-2,6-dienal |
| InChI Key | WTEVQBCEXWBHNA-JXMROGBWSA-N |
| Molecular Formula | C10H16O |
Methyl Arachidate, 99%
CAS: 1120-28-1 Molecular Formula: C21H42O2 Molecular Weight (g/mol): 326.57 MDL Number: MFCD00009014 InChI Key: QGBRLVONZXHAKJ-UHFFFAOYSA-N Synonym: methyl arachidate,eicosanoic acid, methyl ester,arachidic acid methyl ester,methyl eicosanoate,methyl arachisate,arachidic acid methylester,eicosanoic acid methyl ester,methylarachidate,methyl aracidate PubChem CID: 14259 IUPAC Name: methyl icosanoate SMILES: CCCCCCCCCCCCCCCCCCCC(=O)OC
| PubChem CID | 14259 |
|---|---|
| CAS | 1120-28-1 |
| Molecular Weight (g/mol) | 326.57 |
| MDL Number | MFCD00009014 |
| SMILES | CCCCCCCCCCCCCCCCCCCC(=O)OC |
| Synonym | methyl arachidate,eicosanoic acid, methyl ester,arachidic acid methyl ester,methyl eicosanoate,methyl arachisate,arachidic acid methylester,eicosanoic acid methyl ester,methylarachidate,methyl aracidate |
| IUPAC Name | methyl icosanoate |
| InChI Key | QGBRLVONZXHAKJ-UHFFFAOYSA-N |
| Molecular Formula | C21H42O2 |
Potassium sorbate, 99%
CAS: 24634-61-5 Molecular Formula: C6H7KO2 Molecular Weight (g/mol): 150.218 MDL Number: MFCD00016546 InChI Key: CHHHXKFHOYLYRE-STWYSWDKSA-M Synonym: potassium sorbate,sorbistat-k,potassium 2,4-hexadienoate,sorbistat potassium,potassium e,e-sorbate,sorbic acid potassium salt,potassium 2e,4e-hexa-2,4-dienoate,bb powder,sorbistat-potassium,caswell no. 701c PubChem CID: 23676745 ChEBI: CHEBI:77868 IUPAC Name: potassium;(2E,4E)-hexa-2,4-dienoate SMILES: CC=CC=CC(=O)[O-].[K+]
| PubChem CID | 23676745 |
|---|---|
| CAS | 24634-61-5 |
| Molecular Weight (g/mol) | 150.218 |
| ChEBI | CHEBI:77868 |
| MDL Number | MFCD00016546 |
| SMILES | CC=CC=CC(=O)[O-].[K+] |
| Synonym | potassium sorbate,sorbistat-k,potassium 2,4-hexadienoate,sorbistat potassium,potassium e,e-sorbate,sorbic acid potassium salt,potassium 2e,4e-hexa-2,4-dienoate,bb powder,sorbistat-potassium,caswell no. 701c |
| IUPAC Name | potassium;(2E,4E)-hexa-2,4-dienoate |
| InChI Key | CHHHXKFHOYLYRE-STWYSWDKSA-M |
| Molecular Formula | C6H7KO2 |