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Chemical structure of 3-Acetylmorphine

GC40875

3-Acetylmorphine

Also known as [(4R,4aR,7S,7aR,12bS)-7-hydroxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-9-yl] acetate

3-Acetylmorphine (3-MAM) is a less active metabolite of heroin compared to the more active 6-MAM and morphine

ChemicalCAS5140-28-3MW327.4FormulaC19H21NO4
CAS number
5140-28-3
Molecular weight
327.4
Formula
C19H21NO4
Solubility
DMF： 20 mg/ml,DMF：PBS(pH 7·2)(1：1)： 0·5 mg/ml,DMSO： 10 mg/ml
InChIKey
GMLREHXYJDLZOU-LEPYJNQMSA-N
Catalogue number
GC40875
Brand
GLPBIO
Computed properties PubChem CID 5462504 · XLogP 0.9 · TPSA 59 Ų · H-bond donors 1
XLogP
0.9
TPSA
59 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
24

SMILES CC(=O)OC1=C2C3=C(C[C@@H]4[C@H]5[C@]3(CCN4C)[C@@H](O2)[C@H](C=C5)O)C=C1

Computed descriptors from PubChem (CID 5462504), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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