Chemical Compound

Benzoylecgonine D5

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Benzoylecgonine D5 chemical structure
Primary Record

Benzoylecgonine D5

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
76973605
SMILES
[2H]C1=C(C(=C(C(=C1[2H])[2H])C(=O)O[C@H]2C[C@@H]3CC[C@H]([C@H]2C(=O)O)N3C)[2H])[2H]
Canonical SMILES
[2H]c1c([2H])c([2H])c(C(=O)O[C@H]2C[C@@H]3CC[C@H]([C@H]2C(=O)O)N3C)c([2H])c1[2H]

Names & Synonyms

  • Benzoylecgonine D5
  • CS-CX-00164
  • J1.229.525A
  • (1R,2R,3S,5S)-3-[(2,3,4,5,6-2H5)benzoyloxy]-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid