CHEBI:57376 - formyl-CoA(4−)

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ChEBI Name formyl-CoA(4−)
ChEBI ID CHEBI:57376
ChEBI ASCII Name formyl-CoA(4-)
Definition Tetraanion of formyl-CoA arising from deprotonation of phosphate and diphosphate functions.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information No supplier information found for this compound.
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Formula C22H32N7O17P3S
Net Charge -4
Average Mass 791.51200
Monoisotopic Mass 791.08102
InChI InChI=1S/C22H36N7O17P3S/c1-22(2,17(33)20(34)25-4-3-13(31)24-5-6-50-11-30)8-43-49(40,41)46-48(38,39)42-7-12-16(45-47(35,36)37)15(32)21(44-12)29-10-28-14-18(23)26-9-27-19(14)29/h9-12,15-17,21,32-33H,3-8H2,1-2H3,(H,24,31)(H,25,34)(H,38,39)(H,40,41)(H2,23,26,27)(H2,35,36,37)/p-4/t12-,15-,16-,17+,21-/m1/s1
InChIKey SXMOKYXNAPLNCW-GORZOVPNSA-J
SMILES [H]C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP([O-])(=O)OP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP([O-])([O-])=O)n1cnc2c(N)ncnc12
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) See: DOI
Roles Classification
Biological Role(s): human metabolite
Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing formyl-CoA(4−) (CHEBI:57376) has role human metabolite (CHEBI:77746)
formyl-CoA(4−) (CHEBI:57376) is a acyl-CoA(4−) (CHEBI:58342)
formyl-CoA(4−) (CHEBI:57376) is conjugate base of formyl-CoA (CHEBI:15522)
Incoming formyl-CoA (CHEBI:15522) is conjugate acid of formyl-CoA(4−) (CHEBI:57376)
IUPAC Name
3'-phosphonatoadenosine 5'-(3-{(3R)-4-[(3-{[2-(formylsulfanyl)ethyl]amino}-3-oxopropyl)amino]-3-hydroxy-2,2-dimethyl-4-oxobutyl} diphosphate)
Synonym Source
formyl-CoA UniProt
Last Modified
07 July 2014