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CHEBI:760775 - 3'-dephospho-hexadecanoyl-coenzyme A(2-)

Default Structure
ChEBI IDCHEBI:760775
ChEBI Name3'-dephospho-hexadecanoyl-coenzyme A(2-)
Stars
Last Modified21 August 2026
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC37H63N7O14P2S
Net Charge-2
Average Mass923.961
Monoisotopic Mass923.36399
SMILESCCCCCCCCCCCCCCCC(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(C)COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O
InChIInChI=1S/C37H65N7O14P2S/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-28(46)61-21-20-39-27(45)18-19-40-35(50)32(49)37(2,3)23-56-60(53,54)58-59(51,52)55-22-26-30(47)31(48)36(57-26)44-25-43-29-33(38)41-24-42-34(29)44/h24-26,30-32,36,47-49H,4-23H2,1-3H3,(H,39,45)(H,40,50)(H,51,52)(H,53,54)(H2,38,41,42)/p-2/t26-,30-,31-,32+,36-/m1/s1
InChIKeyMPDMTIOIXDAZES-BBECNAHFSA-L
ChEBI Ontology
Outgoing Relation(s)
3'-dephospho-hexadecanoyl-coenzyme A(2-) (CHEBI:760775) has functional parent palmitoyl-CoA(4−) (CHEBI:57379)
3'-dephospho-hexadecanoyl-coenzyme A(2-) (CHEBI:760775) is a organophosphate oxoanion (CHEBI:58945)
UniProt Name  Source
3'-dephospho-hexadecanoyl-CoAUniProt