CHEBI:60454 - Fe-coproporphyrin III

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ChEBI Name Fe-coproporphyrin III
ChEBI ID CHEBI:60454
Definition A metalloporphyrin consisting of coproporphyrin III with a central iron atom.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Serenella
Supplier Information
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Formula C36H36FeN4O8
Net Charge 0
Average Mass 708.53800
Monoisotopic Mass 708.18825
InChI InChI=1S/C36H38N4O8.Fe/c1-17-21(5-9-33(41)42)29-14-27-19(3)22(6-10-34(43)44)30(39-27)15-28-20(4)24(8-12-36(47)48)32(40-28)16-31-23(7-11-35(45)46)18(2)26(38-31)13-25(17)37-29;/h13-16H,5-12H2,1-4H3,(H6,37,38,39,40,41,42,43,44,45,46,47,48);/q;+2/p-2/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-;
InChIKey SXDINBXHOHHTMY-RGGAHWMASA-L
SMILES CC1=C(CCC(O)=O)C2=[N+]3C1=Cc1c(C)c(CCC(O)=O)c4C=C5C(C)=C(CCC(O)=O)C6=[N+]5[Fe--]3(n14)n1c(=C6)c(C)c(CCC(O)=O)c1=C2
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 )
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ChEBI Ontology
Outgoing Fe-coproporphyrin III (CHEBI:60454) has role cofactor (CHEBI:23357)
Fe-coproporphyrin III (CHEBI:60454) is a metalloporphyrin (CHEBI:25216)
Fe-coproporphyrin III (CHEBI:60454) is conjugate acid of Fe-coproporphyrin III(4−) (CHEBI:68438)
Incoming Fe-coproporphyrin III(4−) (CHEBI:68438) is conjugate base of Fe-coproporphyrin III (CHEBI:60454)
IUPAC Name
[3,3',3'',3'''-(3,8,13,17-tetramethylporphyrin-2,7,12,18-tetrayl-κ4N21,N22,N23,N24)tetrapropanoato(2-)]iron
Synonym Source
iron-coproporphyrin III SUBMITTER
Last Modified
26 July 2019