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Details

Stereochemistry ABSOLUTE
Molecular Formula C35H38N2O6
Molecular Weight 582.686
Optical Activity UNSPECIFIED
Defined Stereocenters 10 / 10
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-O-(CODEIN-2-YL)MORPHINE

SMILES

COC1=C(OC2=CC=C3C[C@@H]4[C@@H]5C=C[C@H](O)[C@@H]6OC2=C3[C@]56CCN4C)C=C7C[C@@H]8[C@@H]9C=C[C@H](O)[C@@H]%10OC1=C7[C@]9%10CCN8C

InChI

InChIKey=ASLMZELTZDGCOW-LYWVFRSJSA-N
InChI=1S/C35H38N2O6/c1-36-12-10-34-19-5-7-23(38)32(34)42-29-25(9-4-17(27(29)34)14-21(19)36)41-26-16-18-15-22-20-6-8-24(39)33-35(20,11-13-37(22)2)28(18)31(43-33)30(26)40-3/h4-9,16,19-24,32-33,38-39H,10-15H2,1-3H3/t19-,20-,21+,22+,23-,24-,32-,33-,34-,35-/m0/s1

HIDE SMILES / InChI

Molecular Formula C35H38N2O6
Molecular Weight 582.686
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 10 / 10
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:41:11 GMT 2025
Edited
by admin
on Mon Mar 31 23:41:11 GMT 2025
Record UNII
SC6N3ZX5FG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-O-(CODEIN-2-YL)MORPHINE
Common Name English
CODEINE HYDROCHLORIDE DIHYDRATE IMPURITY D [EP IMPURITY]
Preferred Name English
CODEINE MONOHYDRATE IMPURITY D [EP IMPURITY]
Common Name English
CODEINE PHOSPHATE HEMIHYDRATE IMPURITY D [EP IMPURITY]
Common Name English
CODEINE PHOSPHATE SESQUIHYDRATE IMPURITY D [EP IMPURITY]
Common Name English
2-((4,5.ALPHA.-EPOXY-6.ALPHA.-HYDROXY-17-METHYL-7,8-DIDEHYDROMORPHINAN-3-YL)OXY)-4,5.ALPHA.-EPOXY-3-METHOXY-17-METHYL-7,8-DIDEHYDROMORPHINAN-6.ALPHA.-OL
Systematic Name English
Code System Code Type Description
FDA UNII
SC6N3ZX5FG
Created by admin on Mon Mar 31 23:41:11 GMT 2025 , Edited by admin on Mon Mar 31 23:41:11 GMT 2025
PRIMARY
PUBCHEM
10769855
Created by admin on Mon Mar 31 23:41:11 GMT 2025 , Edited by admin on Mon Mar 31 23:41:11 GMT 2025
PRIMARY
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