Chemical Compound

dinor-OPDA-coA

dinor-OPDA-coA chemical structure
Primary Record

dinor-OPDA-coA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
131801206
SMILES
CC/C=C\C[C@H]1[C@H](C=CC1=O)CCCCCC(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]2[C@H]([C@H]([C@@H](O2)N3C=NC4=C(N=CN=C43)N)O)OP(=O)(O)O)O
Canonical SMILES
CC/C=C\C[C@@H]1C(=O)C=C[C@@H]1CCCCCC(=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

  • dinor-OPDA-coA
  • dnOPDA-coA
  • dnOPDA-coenzyme A
  • dinor-OPDA-coenzyme A
  • CHEBI:139107
  • (9S,13S)-1a,1b-dinor-12-oxo-10,15-phytodienoyl-CoA
  • (9S,13S)-1a,1b-dinor-12-oxo-10,15-phytodienoyl-coenzyme A
  • 6-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}hexanoyl-CoA
  • 6-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}hexanoyl-coenzyme A