geranylgeranyl-chlorophyll a (CHEBI:64668)

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CHEBI:64668 - geranylgeranyl-chlorophyll a

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ChEBI ID	CHEBI:64668
ChEBI Name	geranylgeranyl-chlorophyll a
Stars
ASCII Name	geranylgeranyl-chlorophyll a
Definition	A chlorophyll that is the ester obtained by formal condensation between the carboxy group of chlorophyllide a and the hydroxy group of geranylgeraniol.
Last Modified	9 February 2016
Submitter	Rebecca Foulger
Downloads	Molfile

Formula	C55H66MgN4O5
Net Charge	0
Average Mass	887.461
Monoisotopic Mass	886.48836
SMILES	C=Cc1c(C)c2[n]3c1C=C1C(C)=C(CC)C4=[N+]1[Mg-2]31[n]3c(c(C)c5c3=C(C3=[N+]1C(=C2)[C@@H](C)[C@@H]3CCC(=O)OC/C=C(\C)CC/C=C(\C)CC/C=C(\C)CCC=C(C)C)[C@@H](C(=O)OC)C5=O)=C4
InChI	InChI=1S/C55H67N4O5.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;/h13,18,20,22,26,28-30,37,41,51H,1,14-17,19,21,23-25,27H2,2-12H3,(H-,56,57,58,59,61);/q-1;+2/p-1/b32-20+,33-22+,34-26+;/t37-,41-,51+;/m0./s1
InChIKey	DLGTYWBJNMHIPY-JYVCQAQSSA-M

Roles Classification

Biological Role:

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).

ChEBI Ontology

Outgoing Relation(s)
	geranylgeranyl-chlorophyll a (CHEBI:64668) has functional parent (E,E,E)-geranylgeraniol (CHEBI:46762)
	geranylgeranyl-chlorophyll a (CHEBI:64668) has functional parent chlorophyllide a (CHEBI:16900)
	geranylgeranyl-chlorophyll a (CHEBI:64668) is a carboxylic ester (CHEBI:33308)
	geranylgeranyl-chlorophyll a (CHEBI:64668) is a chlorophyll (CHEBI:28966)

IUPAC Name
[methyl (3S,4S,21R)-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-(3-oxo-3-{[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]oxy}propyl)-9-vinylphorbine-21-carboxylatato(2−)-κ⁴N²³,N²⁴,N²⁵,N²⁶]magnesium

Synonyms	Source
geranylgeranyl-chl a	SUBMITTER
GG-chl a	SUBMITTER
GG-chlorophyll a	SUBMITTER
geranylgeranyl-chlorophyllide a	ChEBI
[methyl (3S,4S,21R)-14-ethyl-4,8,13,18-tetramethyl-20-oxo-3-(3-oxo-3-{[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yl]oxy}propyl)-9-vinylphorbine-21-carboxylatato(2−)-κ⁴N,N']magnesium	ChEBI

Manual Xrefs	Databases
CPD-7005	MetaCyc

Citations