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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H27NO8S
Molecular Weight 489.538
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-HYDROXY DULOXETINE .BETA.-D-GLUCURONIDE

SMILES

CNCC[C@H](OC1=CC=C(O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)C3=C1C=CC=C3)C4=CC=CS4

InChI

InChIKey=OBIZFSZXDHWUJZ-ANUWOGMRSA-N
InChI=1S/C24H27NO8S/c1-25-11-10-17(18-7-4-12-34-18)31-15-8-9-16(14-6-3-2-5-13(14)15)32-24-21(28)19(26)20(27)22(33-24)23(29)30/h2-9,12,17,19-22,24-28H,10-11H2,1H3,(H,29,30)/t17-,19-,20-,21+,22-,24+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
4-HYDROXY DULOXETINE .BETA.-D-GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANOSIDURONIC ACID, 4-((1S)-3-(METHYLAMINO)-1-(2-THIENYL)PROPOXY)-1-NAPHTHALENYL
Systematic Name English
DULOXETINE 4-HYDROXYGLUCURONIDE
Common Name English
LY-550408
Code English
Code System Code Type Description
FDA UNII
GF5FP4W1EJ
Created by admin on Sat Dec 16 13:59:04 GMT 2023 , Edited by admin on Sat Dec 16 13:59:04 GMT 2023
PRIMARY
CAS
741693-83-4
Created by admin on Sat Dec 16 13:59:04 GMT 2023 , Edited by admin on Sat Dec 16 13:59:04 GMT 2023
PRIMARY
PUBCHEM
29981512
Created by admin on Sat Dec 16 13:59:04 GMT 2023 , Edited by admin on Sat Dec 16 13:59:04 GMT 2023
PRIMARY