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Chemistry

Mol. Mass

405.88

ALogP

1.99

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: Cl.CN1CC[C@]23[C@H]4Oc5c(OC(=O)C)ccc(C[C@@H]1[C@@H]2C=C[C@@H]4OC(=O)C)c35
  • InChIKey: FZJYQGFGNHGSFX-PVQKIFDLSA-N
    InChI=1S/C21H23NO5.ClH/c1-11(23)25-16-6-4-13-10-15-14-5-7-17(26-12(2)24)20-21(14,8-9-22(15)3)18(13)19(16)27-20;/h4-7,14-15,17,20H,8-10H2,1-3H3;1H/t14-,15+,17-,20-,21-;/m0./s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2106627   ChEMBL
diacetylmorphine hydrochloride

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