Chemical Compound

E-Phenylitaconyl-CoA

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E-Phenylitaconyl-CoA chemical structure
Primary Record

E-Phenylitaconyl-CoA

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
50986140
SMILES
CC(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-])[C@H](C(=O)NCCC(=O)NCCSC(=O)/C(=C\C4=CC=CC=C4)/CC(=O)[O-])O
Canonical SMILES
CC(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-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)/C(=C\c1ccccc1)CC(=O)[O-]

Names & Synonyms

  • E-Phenylitaconyl-CoA
  • (E)-2-benzylidenesuccinyl-CoA