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CHEBI:57370 - biotinyl-CoA(4−)

ChEBI IDCHEBI:57370
ChEBI Namebiotinyl-CoA(4−)
Stars
ASCII Namebiotinyl-CoA(4-)
DefinitionTetraanion of biotinyl-CoA arising from deprotonation of phosphate and diphosphate functions.
Last Modified2 January 2025
DownloadsMolfile
FormulaC31H46N9O18P3S2
Net Charge-4
Average Mass989.810
Monoisotopic Mass989.16370
SMILES[H][C@]12CS[C@@H](CCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3OP(=O)([O-])[O-])[C@@]1([H])NC(=O)N2
InChIInChI=1S/C31H50N9O18P3S2/c1-31(2,25(44)28(45)34-8-7-19(41)33-9-10-62-20(42)6-4-3-5-18-21-16(12-63-18)38-30(46)39-21)13-55-61(52,53)58-60(50,51)54-11-17-24(57-59(47,48)49)23(43)29(56-17)40-15-37-22-26(32)35-14-36-27(22)40/h14-18,21,23-25,29,43-44H,3-13H2,1-2H3,(H,33,41)(H,34,45)(H,50,51)(H,52,53)(H2,32,35,36)(H2,38,39,46)(H2,47,48,49)/p-4/t16-,17+,18-,21-,23+,24+,25-,29+/m0/s1
InChIKeyWNMONPKUDXWVKE-AJQVAGRLSA-J
ChEBI Ontology
Outgoing Relation(s)
biotinyl-CoA(4−) (CHEBI:57370) is a acyl-CoA(4−) (CHEBI:58342)
biotinyl-CoA(4−) (CHEBI:57370) is conjugate base of biotinyl-CoA (CHEBI:15516)
Incoming Relation(s)
biotinyl-CoA (CHEBI:15516) is conjugate acid of biotinyl-CoA(4−) (CHEBI:57370)
Synonym  Source
biotinyl-coenzyme A(4−)ChEBI
UniProt Name  Source
biotinyl-CoAUniProt
Manual XrefsDatabases
CPD-203MetaCyc