CHEBI:58827 - precorrin-2(7−)

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name precorrin-2(7−)
ChEBI ID CHEBI:58827
ChEBI ASCII Name precorrin-2(7-)
Definition Heptaanionic form of precorrin-2.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C42H41N4O16
Net Charge -7
Average Mass 857.79210
Monoisotopic Mass 857.25560
InChI InChI=1S/C42H48N4O16/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/h14-16,23-24,43-45H,3-13,17-18H2,1-2H3,(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-7/b29-14-,31-15-,32-16-/t23-,24-,41+,42+/m1/s1
InChIKey OQIIYZQTTMKFAU-ZNLOQLQNSA-G
SMILES C[C@]1(CC([O-])=O)[C@H](CCC([O-])=O)\C2=C\c3[nH]c(Cc4[nH]c(\C=C5/N=C(/C=C1\[NH2+]2)[C@@H](CCC([O-])=O)[C@]5(C)CC([O-])=O)c(CC([O-])=O)c4CCC([O-])=O)c(CCC([O-])=O)c3CC([O-])=O
Metabolite of Species Details
Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed
Roles Classification
Biological Role(s): Saccharomyces cerevisiae metabolite
Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing precorrin-2(7−) (CHEBI:58827) has role Saccharomyces cerevisiae metabolite (CHEBI:75772)
precorrin-2(7−) (CHEBI:58827) is a precorrin carboxylic acid anion (CHEBI:59140)
precorrin-2(7−) (CHEBI:58827) is conjugate base of precorrin-2 (CHEBI:50602)
Incoming precorrin-2 (CHEBI:50602) is conjugate acid of precorrin-2(7−) (CHEBI:58827)
IUPAC Name
3,3',3'',3'''-[(7S,8S,12S,13S)-3,8,13,17-tetrakis(carboxylatomethyl)-8,13-dimethyl-7,8,12,13,20,24-hexahydroporphyrin-2,7,12,18-tetrayl]tetrapropanoate
Synonyms Sources
precorrin-2 UniProt
precorrin-2 heptaanion ChEBI
Last Modified
21 January 2016