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Details

Stereochemistry ABSOLUTE
Molecular Formula C18H22N2O10S
Molecular Weight 458.44
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .BETA.-D-GLUCOPYRANURONIC ACID, 1-(5-(((METHYLAMINO)SULFONYL)METHYL)-1H-INDOLE-3-ACETATE)

SMILES

CNS(=O)(=O)CC1=CC=C2NC=C(CC(=O)O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O)C2=C1

InChI

InChIKey=LITWLFMIHOIPGH-RNGZQALNSA-N
InChI=1S/C18H22N2O10S/c1-19-31(27,28)7-8-2-3-11-10(4-8)9(6-20-11)5-12(21)29-18-15(24)13(22)14(23)16(30-18)17(25)26/h2-4,6,13-16,18-20,22-24H,5,7H2,1H3,(H,25,26)/t13-,14-,15+,16-,18+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
.BETA.-D-GLUCOPYRANURONIC ACID, 1-(5-(((METHYLAMINO)SULFONYL)METHYL)-1H-INDOLE-3-ACETATE)
Systematic Name English
GR-49336 GLUCURONIDE
Common Name English
Code System Code Type Description
PUBCHEM
10095668
Created by admin on Sat Dec 16 16:42:08 GMT 2023 , Edited by admin on Sat Dec 16 16:42:08 GMT 2023
PRIMARY
CAS
151751-50-7
Created by admin on Sat Dec 16 16:42:08 GMT 2023 , Edited by admin on Sat Dec 16 16:42:08 GMT 2023
PRIMARY
FDA UNII
GK2323MN4N
Created by admin on Sat Dec 16 16:42:08 GMT 2023 , Edited by admin on Sat Dec 16 16:42:08 GMT 2023
PRIMARY