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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H23NO2.ClH
Molecular Weight 321.842
Optical Activity UNSPECIFIED
Defined Stereocenters 4 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DESOCODEINE HYDROCHLORIDE

SMILES

Cl.[H][C@@]12CCC[C@@]3([H])[C@H]4CC5=C(C(O1)=C(OC)C=C5)[C@@]23CCN4C

InChI

InChIKey=NNVSEQKONSHRCS-GPCGLNPMSA-N
InChI=1S/C18H23NO2.ClH/c1-19-9-8-18-12-4-3-5-15(18)21-17-14(20-2)7-6-11(16(17)18)10-13(12)19;/h6-7,12-13,15H,3-5,8-10H2,1-2H3;1H/t12-,13+,15-,18+;/m0./s1

HIDE SMILES / InChI

Molecular Formula C18H23NO2
Molecular Weight 285.3807
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
U6LZ8PY4WF
Record Status Validated (UNII)
Record Version