Chemical Compound

trans-3-Hexenoyl-CoA

trans-3-Hexenoyl-CoA chemical structure
Primary Record

trans-3-Hexenoyl-CoA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
53477848
SMILES
CC/C=C/CC(=O)SCCNC(=O)CCNC(=O)C(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
CC/C=C/CC(=O)SCCNC(=O)CCNC(=O)C(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

  • trans-3-Hexenoyl-CoA
  • (E)-S-3-hexenoate
  • S-(3E)-3-hexenoate
  • (E)-S-3-hexenoic acid
  • (E)-S-3-hexenoate CoA
  • 3-trans-Hexenoylcoenzyme A
  • S-(3E)-3-hexenoic acid
  • S-(3E)-3-hexenoate CoA
  • (E)-S-3-hexenoate Coenzyme A
  • CHEMBL1949903
  • S-(3E)-3-hexenoate Coenzyme A
  • LMFA07050387
  • {[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-2-{[({[(3-{[2-({2-[(3E)-hex-3-enoylsulfanyl]ethyl}carbamoyl)ethyl]carbamoyl}-3-hydroxy-2,2-dimethylpropoxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl)oxy]methyl}-4-hydroxyoxolan-3-yl]oxy}phosphonic acid