CHEBI:36177 - cytoporphyrin

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ChEBI Name cytoporphyrin
ChEBI ID CHEBI:36177
Definition A cyclic tetrapyrrole that consists of porphyrin bearing several substituents including methyl, vinyl, formyl, hydroxy and hydroxyalkatrienyl. The parent of the class of cytoporphyrins.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information eMolecules:10344509, ZINC000004654776
Download Molfile XML SDF
Formula C49H58N4O6
Net Charge 0
Average Mass 799.00818
Monoisotopic Mass 798.43564
InChI InChI=1S/C49H58N4O6/c1-9-34-31(6)39-25-45-49(46(55)18-12-17-30(5)16-11-15-29(4)14-10-13-28(2)3)33(8)40(52-45)24-44-37(27-54)36(20-22-48(58)59)43(53-44)26-42-35(19-21-47(56)57)32(7)38(51-42)23-41(34)50-39/h9,13,15,17,23-27,46,51-52,55H,1,10-12,14,16,18-22H2,2-8H3,(H,56,57)(H,58,59)/b29-15+,30-17+,38-23-,39-25-,40-24-,41-23-,42-26-,43-26-,44-24-,45-25-
InChIKey OEKBVRFTJDBKQF-OCDAXXDCSA-N
SMILES [H]C(=O)c1c(CCC(O)=O)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5C(O)CC\C=C(/C)CC\C=C(/C)CCC=C(C)C)c(C)c4C=C)c(C)c3CCC(O)=O
Roles Classification
Biological Role(s): cofactor
An organic molecule or ion (usually a metal ion) that is required by an enzyme for its activity. It may be attached either loosely (coenzyme) or tightly (prosthetic group).
(via porphyrins )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cytoporphyrin (CHEBI:36177) is a cytoporphyrins (CHEBI:36178)
cytoporphyrin (CHEBI:36177) is conjugate acid of cytoporphyrinate (CHEBI:36179)
Incoming cytoporphyrinate (CHEBI:36179) is conjugate base of cytoporphyrin (CHEBI:36177)
IUPAC Name
7-ethenyl-17-formyl-12-[(4E,8E)-1-hydroxy-5,9,13-trimethyltetradeca-4,8,12-trien-1-yl]-3,8,13-trimethylporphyrin-2,18-dipropanoic acid
Synonyms Sources
3-formyl-8-[(4E,8E)-1-hydroxy-5,9,13-trimethyltetradeca-4,8,12-trien-1-yl]-7,12,17-trimethyl-13-vinylporphyrin-2,18-dipropanoic acid IUPAC
cytoporphyrin JCBN
porphyrin a ChemIDplus
Registry Numbers Types Sources
1261522 Gmelin Registry Number Gmelin
17404064 Reaxys Registry Number Reaxys
25162-02-1 CAS Registry Number ChemIDplus
5221043 Beilstein Registry Number Beilstein
77538 Reaxys Registry Number Reaxys
Last Modified
14 November 2011