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CHEBI:73096 - divinyl chlorophyll b(1−)

ChEBI IDCHEBI:73096
ChEBI Namedivinyl chlorophyll b(1−)
Stars
ASCII Namedivinyl chlorophyll b(1-)
DefinitionA cyclic tetrapyrrole anion arising from deprotonation at the 21-position of divinyl chlorophyll b.
Last Modified26 July 2019
SubmitterKAX
DownloadsMolfile
FormulaC55H67MgN4O6
Net Charge-1
Average Mass904.468
Monoisotopic Mass903.49165
SMILESC=CC1=C(C=O)C2=[N+]3C1=Cc1c(C)c4c5[n]1[Mg-2]31[n]3c(c(C)c(C=C)c3=C2)=CC2=[N+]1C(=C5[C-](C(=O)OC)C4=O)[C@@H](CCC(=O)OC/C=C(\C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C)[C@@H]2C
InChIInChI=1S/C55H68N4O6.Mg/c1-12-38-35(8)42-27-43-36(9)40(23-24-48(61)65-26-25-34(7)22-16-21-33(6)20-15-19-32(5)18-14-17-31(3)4)52(58-43)50-51(55(63)64-11)54(62)49-37(10)44(59-53(49)50)28-46-39(13-2)41(30-60)47(57-46)29-45(38)56-42;/h12-13,25,27-33,36,40H,1-2,14-24,26H2,3-11H3,(H-,56,57,58,59,60,62);/q-2;+2/p-1/b34-25+;/t32-,33-,36+,40+;/m1./s1
InChIKeyXCSMCRBINIVJRP-YKKLGNEQSA-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)
divinyl chlorophyll b(1−) (CHEBI:73096) has role cofactor (CHEBI:23357)
divinyl chlorophyll b(1−) (CHEBI:73096) is a cyclic tetrapyrrole anion (CHEBI:58941)
divinyl chlorophyll b(1−) (CHEBI:73096) is conjugate base of divinyl chlorophyll b (CHEBI:73115)
Incoming Relation(s)
divinyl chlorophyll b (CHEBI:73115) is conjugate acid of divinyl chlorophyll b(1−) (CHEBI:73096)
IUPAC Name 
[methyl (3S,4S)-13-formyl-4,8,18-trimethyl-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(3−)-κ4N23,N24,N25,N26]magnesate(1−)
UniProt Name  Source
divinyl chlorophyll bUniProt
Citations