CHEBI:73113 - divinyl chlorophyll a

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name divinyl chlorophyll a
ChEBI ID CHEBI:73113
ChEBI ASCII Name divinyl chlorophyll a
Definition A carboxylic ester obtained by formal condensation of the carboxy group of divinyl chlorophyll a with the hydroxy group of (2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-ol.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ZINC000064622623
Download Molfile XML SDF
Formula C55H70MgN4O5
Net Charge 0
Average Mass 891.47310
Monoisotopic Mass 890.51966
InChI InChI=1S/C55H71N4O5.Mg/c1-13-39-35(8)42-28-44-37(10)41(24-25-48(60)64-27-26-34(7)23-17-22-33(6)21-16-20-32(5)19-15-18-31(3)4)52(58-44)50-51(55(62)63-12)54(61)49-38(11)45(59-53(49)50)30-47-40(14-2)36(9)43(57-47)29-46(39)56-42;/h13-14,26,28-33,37,41,51H,1-2,15-25,27H2,3-12H3,(H-,56,57,58,59,61);/q-1;+2/p-1/b34-26+;/t32-,33-,37+,41+,51-;/m1./s1
InChIKey COQGSKNKQZLZEJ-AENOIHSZSA-M
SMILES COC(=O)[C@H]1C(=O)c2c(C)c3=CC4=[N+]5C(=Cc6c(C=C)c(C)c7C=C8[C@@H](C)[C@H](CCC(=O)OC\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)C9=[N+]8[Mg--]5(n67)n3c2=C19)C(C)=C4C=C
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 divinyl chlorophyll a (CHEBI:73113) has functional parent divinyl chlorophyllide a (CHEBI:38259)
divinyl chlorophyll a (CHEBI:73113) has role cofactor (CHEBI:23357)
divinyl chlorophyll a (CHEBI:73113) is a chlorophyll (CHEBI:28966)
divinyl chlorophyll a (CHEBI:73113) is a methyl ester (CHEBI:25248)
divinyl chlorophyll a (CHEBI:73113) is conjugate acid of divinyl chlorophyll a(1−) (CHEBI:73095)
Incoming divinyl chlorophyll a(1−) (CHEBI:73095) is conjugate base of divinyl chlorophyll a (CHEBI:73113)
IUPAC Name
[methyl (3S,4S,21R)-4,8,13,18-tetramethyl-20-oxo-3-(3-oxo-3-{[(2E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-yl]oxy}propyl)-9,14-divinylphorbine-21-carboxylatato(2−)-κ4N23,N24,N25,N26]magnesium
Synonym Source
Divinylchlorophyll a KEGG COMPOUND
Manual Xref Database
C11850 KEGG COMPOUND
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Registry Number Type Source
21120522 Reaxys Registry Number Reaxys
Citations Waiting for Citations
Last Modified
26 July 2019