CHEBI:62810 - cis-heme d hydroxychlorin γ-spirolactone methyl ester

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ChEBI Name cis-heme d hydroxychlorin γ-spirolactone methyl ester
ChEBI ID CHEBI:62810
ChEBI ASCII Name cis-heme d hydroxychlorin gamma-spirolactone methyl ester
Definition A carboxylic ester that is the methyl ester of cis-heme d hydroxychlorin γ-spirolactone.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C35H34FeN4O5
Net Charge 0
Average Mass 646.51300
Monoisotopic Mass 646.18786
InChI InChI=1S/C35H34N4O5.Fe/c1-8-21-18(3)24-14-25-20(5)23(10-11-32(40)43-7)29(38-25)17-31-35(13-12-33(41)44-35)34(6,42)30(39-31)16-28-22(9-2)19(4)26(37-28)15-27(21)36-24;/h8-9,14-17,42H,1-2,10-13H2,3-7H3;/q-2;+2/t34-,35+;/m0./s1
InChIKey HSOAODYTIXUNJD-PFHIRXQESA-N
SMILES COC(=O)CCc1c(C)c2=CC3=[N+]4C(=Cc5c(C)c(C=C)c6C=C7[N+]8=C(C=c1n2[Fe--]48n56)[C@]1(CCC(=O)O1)[C@@]7(C)O)C(C=C)=C3C
Roles Classification
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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cis-heme d hydroxychlorin γ-spirolactone methyl ester (CHEBI:62810) has functional parent cis-heme d hydroxychlorin γ-spirolactone (CHEBI:47459)
cis-heme d hydroxychlorin γ-spirolactone methyl ester (CHEBI:62810) has functional parent methanol (CHEBI:17790)
cis-heme d hydroxychlorin γ-spirolactone methyl ester (CHEBI:62810) is a γ-lactone (CHEBI:37581)
cis-heme d hydroxychlorin γ-spirolactone methyl ester (CHEBI:62810) is a azaspiro compound (CHEBI:35624)
cis-heme d hydroxychlorin γ-spirolactone methyl ester (CHEBI:62810) is a ferroheme (CHEBI:38573)
cis-heme d hydroxychlorin γ-spirolactone methyl ester (CHEBI:62810) is a metallochlorin (CHEBI:62804)
cis-heme d hydroxychlorin γ-spirolactone methyl ester (CHEBI:62810) is a methyl ester (CHEBI:25248)
cis-heme d hydroxychlorin γ-spirolactone methyl ester (CHEBI:62810) is a oxaspiro compound (CHEBI:37948)
IUPAC Name
{methyl 3-[(2RS,5'SR)-9',14'-diethenyl-5'-hydroxy-5',10',15',19'-tetramethyl-5-oxo-4,5-dihydro-3H-spiro[furan-2,4'-[21,22,23,24]tetraazapentacyclo[16.2.1.13,6.18,11.113,16]tetracosa[1,3(24),6,8,10,12,14,16(22),17,19]decaen]-20'-yl-κ4N21',N22',N23',N24']propanoatato(2−)}iron
Citation Waiting for Citations Type Source
7663946 PubMed citation Europe PMC
Last Modified
16 March 2015