CHEBI:91128 - 3-acetylchlorophyllide a

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-acetylchlorophyllide a
ChEBI ID CHEBI:91128
ChEBI ASCII Name 3-acetylchlorophyllide a
Definition A chlorophyllide obtained by hydrolysis of the terpenoid ester moiety of 3-acetylchlorophyll a.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C35H34MgN4O6
Net Charge 0
Average Mass 630.974
Monoisotopic Mass 630.23288
InChI InChI=1S/C35H36N4O6.Mg/c1-8-19-14(2)21-13-26-28(18(6)40)16(4)23(37-26)11-22-15(3)20(9-10-27(41)42)32(38-22)30-31(35(44)45-7)34(43)29-17(5)24(39-33(29)30)12-25(19)36-21;/h11-13,15,20,31H,8-10H2,1-7H3,(H3,36,37,38,39,40,41,42,43);/q;+2/p-2/t15-,20-,31+;/m0./s1
InChIKey IRCCOQFJBKCMIV-CUSHWANBSA-L
SMILES C=12N3C(=CC4=[N+]5C(=CC=6N7C=8C(=C9[N+](=C(C1)[C@H]([C@@H]9CCC(O)=O)C)[Mg-2]735)[C@H](C(C8C6C)=O)C(=O)OC)C(=C4C)CC)C(=C2C)C(=O)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): bacterial metabolite
Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
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 3-acetylchlorophyllide a (CHEBI:91128) has role bacterial metabolite (CHEBI:76969)
3-acetylchlorophyllide a (CHEBI:91128) is a chlorophyllide (CHEBI:38206)
3-acetylchlorophyllide a (CHEBI:91128) is a dicarboxylic acid monoester (CHEBI:36244)
3-acetylchlorophyllide a (CHEBI:91128) is a methyl ester (CHEBI:25248)
3-acetylchlorophyllide a (CHEBI:91128) is a methyl ketone (CHEBI:51867)
3-acetylchlorophyllide a (CHEBI:91128) is conjugate acid of 3-acetylchlorophyllide a(2−) (CHEBI:90794)
Incoming 3-acetylchlorophyllide a(2−) (CHEBI:90794) is conjugate base of 3-acetylchlorophyllide a (CHEBI:91128)
IUPAC Name
{3-[(3S,4S,21R)-9-acetyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxophorbin-3-yl-κ4N23,N24,N25,N26]propanoato(2−)}magnesium
Synonym Source
3-devinyl-3-acetyl-chlorophyllide a MetaCyc
Manual Xref Database
CPD-18840 MetaCyc
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Citation Waiting for Citations Type Source
26088139 PubMed citation Europe PMC
Last Modified
09 February 2016