U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C18H23NO3.C4H6O6.3H2O
Molecular Weight 505.5128
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIHYDROISOCODEINE TARTRATE TRIHYDRATE

SMILES

O.O.O.O[C@H]([C@@H](O)C(O)=O)C(O)=O.[H][C@@]12OC3=C(OC)C=CC4=C3[C@@]15CCN(C)[C@]([H])(C4)[C@]5([H])CC[C@H]2O

InChI

InChIKey=VQMMBVUUOWJBFY-MKSZETLLSA-N
InChI=1S/C18H23NO3.C4H6O6.3H2O/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;5-1(3(7)8)2(6)4(9)10;;;/h3,6,11-13,17,20H,4-5,7-9H2,1-2H3;1-2,5-6H,(H,7,8)(H,9,10);3*1H2/t11-,12+,13+,17-,18-;1-,2-;;;/m01.../s1

HIDE SMILES / InChI

Approval Year

Name Type Language
DIHYDROISOCODEINE TARTRATE TRIHYDRATE
Common Name English
DIHYDROISOCODEINE ACID TARTRATE TRIHYDRATE
MI  
Common Name English
DIHYDROISOCODEINE ACID TARTRATE TRIHYDRATE [MI]
Common Name English
MORPHINAN-6-OL, 4,5-EPOXY-3-METHOXY-17-METHYL-, (5.ALPHA.,6.BETA.)-, (2R,3R)-2,3-DIHYDROXYBUTANEDIOATE (1:1) (SALT), TRIHYDRATE
Systematic Name English
Code System Code Type Description
MERCK INDEX
m4463
Created by admin on Sat Dec 16 09:40:10 GMT 2023 , Edited by admin on Sat Dec 16 09:40:10 GMT 2023
PRIMARY Merck Index
FDA UNII
DE5VRA4X6Z
Created by admin on Sat Dec 16 09:40:10 GMT 2023 , Edited by admin on Sat Dec 16 09:40:10 GMT 2023
PRIMARY
CAS
6202-08-0
Created by admin on Sat Dec 16 09:40:10 GMT 2023 , Edited by admin on Sat Dec 16 09:40:10 GMT 2023
PRIMARY
PUBCHEM
76962249
Created by admin on Sat Dec 16 09:40:10 GMT 2023 , Edited by admin on Sat Dec 16 09:40:10 GMT 2023
PRIMARY