CHEBI:62806 - iron methylchlorin

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ChEBI Name iron methylchlorin
ChEBI ID CHEBI:62806
Definition A metallochlorin that is the iron(II) complex of 7,8-dihydroporphyrin which is substituted by methyl groups at positions 3, 7, 7, 8, 12, 13, and 17, and by carboxyethyl groups at positions 2 and 18.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C33H36FeN4O4
Net Charge 0
Average Mass 608.50800
Monoisotopic Mass 608.20859
InChI InChI=1S/C33H38N4O4.Fe/c1-16-17(2)24-13-27-20(5)33(6,7)30(37-27)15-26-19(4)22(9-11-32(40)41)29(36-26)14-28-21(8-10-31(38)39)18(3)25(35-28)12-23(16)34-24;/h12-15,20H,8-11H2,1-7H3,(H4,34,35,36,37,38,39,40,41);/q;+2/p-2
InChIKey ZJLLQWSACVGYEC-UHFFFAOYSA-L
SMILES CC1C2=[N+]3C(=Cc4c(C)c(CCC(O)=O)c5C=C6C(CCC(O)=O)=C(C)C7=[N+]6[Fe--]3(n45)n3c(=C2)c(C)c(C)c3=C7)C1(C)C
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via heme )
prosthetic group
A tightly bound, specific nonpolypeptide unit in a protein determining and involved in its biological activity.
(via heme )
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 iron methylchlorin (CHEBI:62806) is a dicarboxylic acid (CHEBI:35692)
iron methylchlorin (CHEBI:62806) is a ferroheme (CHEBI:38573)
iron methylchlorin (CHEBI:62806) is a metallochlorin (CHEBI:62804)
iron methylchlorin (CHEBI:62806) is conjugate acid of iron methylchlorin(2−) (CHEBI:62807)
Incoming iron methylchlorin(2−) (CHEBI:62807) is conjugate base of iron methylchlorin (CHEBI:62806)
IUPAC Name
[3,3'-(3,7,7,8,12,13,17-heptamethyl-7,8-dihydroporphyrin-2,18-diyl-κ4N21,N22,N23,N24)dipropanoato(2−)]iron
Citation Waiting for Citations Type Source
11162466 PubMed citation Europe PMC
Last Modified
25 August 2011