MetaADEDB 2.0 @ LMMD
cocaethylene
(NMPOSNRHZIWLLL-XUWVNRHRSA-N)
Structure
SMILES
CCOC(=O)[C@H]1[C@H](C[C@H]2N([C@@H]1CC2)C)OC(=O)c1ccccc1
Molecular Formula:
C18H23NO4
Molecular Weight:
317.380
Log P:
2.1957
Hydrogen Bond Acceptor:
5
Hydrogen Bond Donor:
0
TPSA:
55.84
CAS Number(s):
529-38-4
Synonym(s)
1.
cocaethylene
2.
benzoylecgonine ethyl ester
3.
coca-ethylene
4.
ethyl (1R,2R,3S,5S)-3-benzoyloxy-8-methyl-8-azabicyclo(3.2.1)octane-2-carboxylate
5.
ethylcocaine
External Link(s)
MeSHC066444
PubChem Compound644006
ZINC4214983
Adverse Drug Event(s)
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