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Details

Stereochemistry ABSOLUTE
Molecular Formula C21H23NO5
Molecular Weight 378.4665
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIAMORPHINE, (N-METHYL-D3, DIACETATE-D6)-

SMILES

[2H]C([2H])([2H])N1CC[C@@]23[C@H]4OC5=C2C(C[C@@H]1[C@@H]3C=C[C@@H]4OC(=O)C([2H])([2H])[2H])=CC=C5OC(=O)C([2H])([2H])[2H]

InChI

InChIKey=GVGLGOZIDCSQPN-OYCCCKEBSA-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/i1D3,2D3,3D3

HIDE SMILES / InChI

Approval Year

Name Type Language
DIAMORPHINE, (N-METHYL-D3, DIACETATE-D6)-
Common Name English
DIAMORPHINE, D9-
Preferred Name English
HEROIN-D9
Common Name English
MORPHINAN-3,6-DIOL, 7,8-DIDEHYDRO-4,5-EPOXY-17-(METHYL-D3)-, 3,6-DI(ACETATE-2,2,2-D3), (5.ALPHA.,6.ALPHA.)-
Systematic Name English
Code System Code Type Description
PUBCHEM
117065092
Created by admin on Tue Apr 01 17:02:07 GMT 2025 , Edited by admin on Tue Apr 01 17:02:07 GMT 2025
PRIMARY
FDA UNII
K3XFJ493VT
Created by admin on Tue Apr 01 17:02:07 GMT 2025 , Edited by admin on Tue Apr 01 17:02:07 GMT 2025
PRIMARY
CAS
1338713-49-7
Created by admin on Tue Apr 01 17:02:07 GMT 2025 , Edited by admin on Tue Apr 01 17:02:07 GMT 2025
PRIMARY
EPA CompTox
DTXSID301345288
Created by admin on Tue Apr 01 17:02:07 GMT 2025 , Edited by admin on Tue Apr 01 17:02:07 GMT 2025
PRIMARY