diacetylmorphine Report issue

Small molecule Experimental
AACT ChEMBL DrugBank Drug Central PubChem

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Chemistry

Mol. Mass

369.42

ALogP

1.99

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CC(=O)Oc1ccc2c3c1O[C@H]1[C@@H](OC(C)=O)C=C[C@H]4[C@@H](C2)N(C)CC[C@@]341
  • InChIKey: GVGLGOZIDCSQPN-PVHGPHFFSA-N
    InChI=1S/C21H23NO5/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/t14-,15+,17-,20-,21-/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL459324   ChEMBL
diacetylmorphine

Heroin   Wikipedia

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