Chemical Compound

S-(2-OXO)PENTADECYLCOA

S-(2-OXO)PENTADECYLCOA chemical structure
Primary Record

S-(2-OXO)PENTADECYLCOA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
449362
SMILES
CCCCCCCCCCCCCC(=O)CSCCNC(=O)CCNC(=O)[C@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
Canonical SMILES
CCCCCCCCCCCCCC(=O)CSCCNC(=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]1OP(=O)(O)O

Names & Synonyms

  • S-(2-OXO)PENTADECYLCOA
  • RefChem:884136
  • AC1L9N17
  • SCHEMBL30583329
  • CID449362
  • NSC622054
  • DB02271
  • NS00073487
  • [[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl]methoxy-hydroxyphosphoryl] [(3S)-3-hydroxy-2,2-dimethyl-4-oxo-4-[[3-oxo-3-[2-(2-oxopentadecylsulfanyl)ethylamino]propyl]amino]butyl] hydrogen phosphate
  • NHM
  • (((2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-4-hydroxy-3-phosphonooxyoxolan-2-yl)methoxy-hydroxyphosphoryl) ((3S)-3-hydroxy-2,2-dimethyl-4-oxo-4-((3-oxo-3-(2-(2-oxopentadecylsulfanyl)ethylamino)propyl)amino)butyl) hydrogen phosphate
  • [(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]methyl (3S)-3-hydroxy-2,2-dimethyl-4-oxo-4-{[3-oxo-3-({2-[(2-oxopentadecyl)sulfanyl]ethyl}amino)propyl]amino}butyl dihydrogen diphosphate (non-preferred name)