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CHEBI:58351 - sirohydrochlorin(8−)

ChEBI IDCHEBI:58351
ChEBI Namesirohydrochlorin(8−)
Stars
ASCII Namesirohydrochlorin(8-)
DefinitionAn octuply-charged cyclic tetrapyrrole anion arising from global deprotonation of the carboxy groups of sirohydrochlorin; major species at pH 7.3.
Last Modified26 July 2019
DownloadsMolfile
FormulaC42H38N4O16
Net Charge-8
Average Mass854.778
Monoisotopic Mass854.23267
SMILESC[C@@]1(CC(=O)[O-])c2cc3nc(cc4nc(cc5nc(cc(n2)[C@H]1CCC(=O)[O-])[C@@](C)(CC(=O)[O-])[C@@H]5CCC(=O)[O-])C(CC(=O)[O-])=C4CCC(=O)[O-])c(CCC(=O)[O-])c3CC(=O)[O-]
InChIInChI=1S/C42H46N4O16/c1-41(17-39(59)60)23(5-9-35(51)52)29-14-27-21(11-37(55)56)19(3-7-33(47)48)25(43-27)13-26-20(4-8-34(49)50)22(12-38(57)58)28(44-26)15-31-42(2,18-40(61)62)24(6-10-36(53)54)30(46-31)16-32(41)45-29/h13-16,23-24,44-45H,3-12,17-18H2,1-2H3,(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)(H,61,62)/p-8/b25-13-,29-14-,31-15-,32-16-/t23-,24-,41+,42+/m1/s1
InChIKeyKWIZRXMMFRBUML-AHGFGAHVSA-F
Species of MetaboliteComponentSourceComments
Saccharomyces cerevisiae (ncbitaxon:4932) - PubMed (24678285) Source: yeast.sf.net
Roles Classification
Biological Roles:
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).
Saccharomyces cerevisiae metabolite  Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
ChEBI Ontology
Outgoing Relation(s)
sirohydrochlorin(8−) (CHEBI:58351) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
sirohydrochlorin(8−) (CHEBI:58351) has role cofactor (CHEBI:23357)
sirohydrochlorin(8−) (CHEBI:58351) is a cyclic tetrapyrrole anion (CHEBI:58941)
sirohydrochlorin(8−) (CHEBI:58351) is conjugate base of sirohydrochlorin (CHEBI:18023)
Incoming Relation(s)
sirohydrochlorin (CHEBI:18023) is conjugate acid of sirohydrochlorin(8−) (CHEBI:58351)
IUPAC Name 
3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxylatomethyl)-8,13-dimethyl-7,8,12,13-tetrahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoate
Synonym  Source
sirohydrochlorin octaanionChEBI
UniProt Name  Source
sirohydrochlorinUniProt