Chemical Compound

2-hydroxyisovaleryl-CoA

2-hydroxyisovaleryl-CoA chemical structure
Primary Record

2-hydroxyisovaleryl-CoA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
90190145
SMILES
CC(C)C(C(=O)SCCNC(=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)O
Canonical SMILES
CC(C)C(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](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)(O)O

Names & Synonyms

  • 2-hydroxyisovaleryl-CoA
  • 2-hydroxyisovaleryl-coenzyme A
  • 2-hydroxy-3-methylbutanoyl-CoA
  • SCHEMBL15757990
  • SCHEMBL30221039
  • CHEBI:138964
  • 2-hydroxy-3-methylbutanoyl-coenzyme A
  • 3'-phosphoadenosine 5'-{3-[(3R)-3-hydroxy-4-{[3-({2-[(2-hydroxy-3-methylbutanoyl)sulfanyl]ethyl}amino)-3-oxopropyl]amino}-2,2-dimethyl-4-oxobutyl] dihydrogen diphosphate}