CHEBI:83578 - 2-carboxyhexacosanoyl-CoA(5−)

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ChEBI Name 2-carboxyhexacosanoyl-CoA(5−) ChEBI ID CHEBI:83578 ChEBI ASCII Name 2-carboxyhexacosanoyl-CoA(5-) Definition The pentaanion of 2-carboxyhexacosanoyl-CoA arising from deprotonation of phosphate, diphosphate and carboxylic acid functions; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Nevila Nouspikel Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C48H81N7O19P3S Net Charge -5 Average Mass 1185.18100 Monoisotopic Mass 1184.45482 InChI InChI=1S/C48H86N7O19P3S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-35(46(60)61)47(62)78-30-29-50-37(56)27-28-51-44(59)41(58)48(2,3)32-71-77(68,69)74-76(66,67)70-31-36-40(73-75(63,64)65)39(57)45(72-36)55-34-54-38-42(49)52-33-53-43(38)55/h33-36,39-41,45,57-58H,4-32H2,1-3H3,(H,50,56)(H,51,59)(H,60,61)(H,66,67)(H,68,69)(H2,49,52,53)(H2,63,64,65)/p-5/t35?,36-,39-,40-,41+,45-/m1/s1 InChIKey VUYDEKMWDHLSSI-RVNPWDOLSA-I SMILES CCCCCCCCCCCCCCCCCCCCCCCCC(C([O-])=O)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 ChEBI Ontology Outgoing 2-carboxyhexacosanoyl-CoA(5−) (CHEBI:83578) is a 2-carboxyacyl CoA(5−) (CHEBI:84128) 2-carboxyhexacosanoyl-CoA(5−) (CHEBI:83578) is conjugate base of 2-carboxyhexacosanoyl-CoA (CHEBI:84305) Incoming 2-carboxyhexacosanoyl-CoA (CHEBI:84305) is conjugate acid of 2-carboxyhexacosanoyl-CoA(5−) (CHEBI:83578) Synonym Source 2-carboxyhexacosanoyl-CoA UniProt Citation Type Source 16354663 PubMed citation SUBMITTER Last Modified 15 January 2015