benzoylecgonine

MediLexicon benzoylecgonine - Medical Dictionary Definition for Term 'benzoylecgonine'

[1. A metabolite of cocaine produced by hydrolysis; it can be detected in urine.

Molecular Formula: C16H19NO4


InChI: InChI=1/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)/t11?,12?,13-,14+/m0/s1/f/h18H

InChIKey: InChIKey=GVGYEFKIHJTNQZ-ALDNJRMPDV
SMILES: CN1C2CCC1C(C(C2)OC(=O)C3=CC=CC=C3)C(=O)O

Names:
    benzoylecgonine
    C10847
    (2R,3S)-3-benzoyloxy-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid
    519-09-5

Registries:
    PubChem CID 442997
    PubChem ID 13030