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CAS RN 16009-13-5

H3CNNNNCH3CH2CH3H2CH3CHOOHOOFeCl(Z)(Z)(Z)(Z)

CAS RN 16009-13-5

IUPAC Name: iron(3+) 4,20-bis(2-carboxyethyl)-9,14-diethenyl-5,10,15,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1³,⁶.1⁸,¹¹.1¹³,¹⁶]tetracosa-1(20),2,4,6(24),7,9,11,13(22),14,16,18-undecaene-21,23-diide
Synonyms: hemin
Molecular Weight (g/mol): 616.5
Molecular Formula: C34H32FeN4O4
InChi Key: GGIDWJQWCUJYRY-UHFFFAOYSA-L
SMILES: [Fe+3].CC1=C2[N-]C(C=C3N=C(C=C4[N-]C(=CC5=NC(=C2)C(C)=C5C=C)C(C)=C4C=C)C(C)=C3CCC(O)=O)=C1CCC(O)=O
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1

Thermo Scientific Chemicals Hemin, 98%, porcine

CAS: 16009-13-5 Molecular Formula: C34H32ClFeN4O4 Molecular Weight (g/mol): 651.95 MDL Number: MFCD00010726 InChI Key: BTIJJDXEELBZFS-HXFTUNQESA-K Synonym: chlorohemin,hemin chloride,protoferriheme,ferriheme,ferriprotoporphyrin ix chloride,ferriprotoporphyrin ix,panhematin,protohemin,protohemin ix,ferriprotoporphyrin PubChem CID: 131675604 IUPAC Name: 3-[(1Z,6Z,12Z,17Z)-5-(2-carboxyethyl)-22-chloro-15,20-diethenyl-4,10,14,19-tetramethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1³,⁶.1¹³,¹⁶.0⁸,²³.0¹⁸,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaen-9-yl]propanoic acid SMILES: CC1=C(CCC(O)=O)\C2=C\C3=C(CCC(O)=O)C(C)=C4\C=C5/N=C(/C=C6\N([Fe](Cl)N34)\C(=C/C1=N2)C(C=C)=C6C)C(C=C)=C5C

EDGE
PubChem CID 131675604
CAS 16009-13-5
Molecular Weight (g/mol) 651.95
MDL Number MFCD00010726
SMILES CC1=C(CCC(O)=O)\C2=C\C3=C(CCC(O)=O)C(C)=C4\C=C5/N=C(/C=C6\N([Fe](Cl)N34)\C(=C/C1=N2)C(C=C)=C6C)C(C=C)=C5C
Synonym chlorohemin,hemin chloride,protoferriheme,ferriheme,ferriprotoporphyrin ix chloride,ferriprotoporphyrin ix,panhematin,protohemin,protohemin ix,ferriprotoporphyrin
IUPAC Name 3-[(1Z,6Z,12Z,17Z)-5-(2-carboxyethyl)-22-chloro-15,20-diethenyl-4,10,14,19-tetramethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1³,⁶.1¹³,¹⁶.0⁸,²³.0¹⁸,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaen-9-yl]propanoic acid
InChI Key BTIJJDXEELBZFS-HXFTUNQESA-K
Molecular Formula C34H32ClFeN4O4
2

Hemin (porcine), 97+%

CAS: 16009-13-5 Molecular Formula: C34H32ClFeN4O4 Molecular Weight (g/mol): 651.95 MDL Number: MFCD00010726 InChI Key: BTIJJDXEELBZFS-HXFTUNQESA-K Synonym: chlorohemin,hemin chloride,protoferriheme,ferriheme,ferriprotoporphyrin ix chloride,ferriprotoporphyrin ix,panhematin,protohemin,protohemin ix,ferriprotoporphyrin PubChem CID: 131675604 IUPAC Name: 3-[(1Z,6Z,12Z,17Z)-5-(2-carboxyethyl)-22-chloro-15,20-diethenyl-4,10,14,19-tetramethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1³,⁶.1¹³,¹⁶.0⁸,²³.0¹⁸,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaen-9-yl]propanoic acid SMILES: CC1=C(CCC(O)=O)\C2=C\C3=C(CCC(O)=O)C(C)=C4\C=C5/N=C(/C=C6\N([Fe](Cl)N34)\C(=C/C1=N2)C(C=C)=C6C)C(C=C)=C5C

PubChem CID 131675604
CAS 16009-13-5
Molecular Weight (g/mol) 651.95
MDL Number MFCD00010726
SMILES CC1=C(CCC(O)=O)\C2=C\C3=C(CCC(O)=O)C(C)=C4\C=C5/N=C(/C=C6\N([Fe](Cl)N34)\C(=C/C1=N2)C(C=C)=C6C)C(C=C)=C5C
Synonym chlorohemin,hemin chloride,protoferriheme,ferriheme,ferriprotoporphyrin ix chloride,ferriprotoporphyrin ix,panhematin,protohemin,protohemin ix,ferriprotoporphyrin
IUPAC Name 3-[(1Z,6Z,12Z,17Z)-5-(2-carboxyethyl)-22-chloro-15,20-diethenyl-4,10,14,19-tetramethyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1³,⁶.1¹³,¹⁶.0⁸,²³.0¹⁸,²¹]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaen-9-yl]propanoic acid
InChI Key BTIJJDXEELBZFS-HXFTUNQESA-K
Molecular Formula C34H32ClFeN4O4
3

Hemin Chloride (Technical grade), TRC

CAS: 16009-13-5 Molecular Formula: C34H32ClFeN4O4 Molecular Weight (g/mol): 651.94 Synonym: 1,3,5,8-Tetramethyl-2,4-divinylporphine-6,7-dipropionic Acid ferrichloride Chloro[dihydrogen 3,7,12,17-Tetramethyl-8,13-divinyl-2,18-porphinedipropionato(2-)]iron,Chlorohemin,Chloroprotoferriheme,Chloroprotohemin,Ferric Hemin,Ferriheme,Ferriheme Chloride,Ferriporphyrin Chloride,Ferriprotoporphyrin,Ferriprotoporphyrin IX,Ferriprotoporphyrin IX Chloride,Hemin,Hemin IX,Hemin Chloride,Iron(III) Protoporphyrin Chloride,KJB 003,Panhematin,Protoferriheme,Protohemin,Protohemin Chloride,Teichmann's Crystals SMILES: [Cl-][Fe+3]123N4=C5C=C6C(=C(C=C)C(=CC7=N1C(=CC8=C(CCC(=O)O)C(=C(C=C4C(=C5C=C)C)[N-]28)C)C(=C7C)CCC(=O)O)[N-]36)C

CAS 16009-13-5
Molecular Weight (g/mol) 651.94
SMILES [Cl-][Fe+3]123N4=C5C=C6C(=C(C=C)C(=CC7=N1C(=CC8=C(CCC(=O)O)C(=C(C=C4C(=C5C=C)C)[N-]28)C)C(=C7C)CCC(=O)O)[N-]36)C
Synonym 1,3,5,8-Tetramethyl-2,4-divinylporphine-6,7-dipropionic Acid ferrichloride Chloro[dihydrogen 3,7,12,17-Tetramethyl-8,13-divinyl-2,18-porphinedipropionato(2-)]iron,Chlorohemin,Chloroprotoferriheme,Chloroprotohemin,Ferric Hemin,Ferriheme,Ferriheme Chloride,Ferriporphyrin Chloride,Ferriprotoporphyrin,Ferriprotoporphyrin IX,Ferriprotoporphyrin IX Chloride,Hemin,Hemin IX,Hemin Chloride,Iron(III) Protoporphyrin Chloride,KJB 003,Panhematin,Protoferriheme,Protohemin,Protohemin Chloride,Teichmann's Crystals
Molecular Formula C34H32ClFeN4O4