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

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H23NO10
Molecular Weight 485.4401
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(4-HYDROXYPHENYL)-5-PHENYL-2-OXAZOLEPROPANOIC ACID ESTER GLUCURONIDE

SMILES

O[C@@H]1[C@@H](O)[C@H](O)[C@H](O[C@H]1OC(=O)CCC2=NC(=C(O2)C3=CC=CC=C3)C4=CC=C(O)C=C4)C(O)=O

InChI

InChIKey=GQCBWWAUYHUJOD-MJRVOHGCSA-N
InChI=1S/C24H23NO10/c26-14-8-6-12(7-9-14)17-21(13-4-2-1-3-5-13)33-15(25-17)10-11-16(27)34-24-20(30)18(28)19(29)22(35-24)23(31)32/h1-9,18-20,22,24,26,28-30H,10-11H2,(H,31,32)/t18-,19-,20+,22-,24+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
4-(4-HYDROXYPHENYL)-5-PHENYL-2-OXAZOLEPROPANOIC ACID ESTER GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANURONIC ACID, 1-(4-(4-HYDROXYPHENYL)-5-PHENYL-2-OXAZOLEPROPANOATE)
Systematic Name English
DES(4-(PHENYL))-4-(4-HYDROXYPHENYL)OXAPROZIN GLUCURONIDE
Common Name English
Code System Code Type Description
PUBCHEM
91810533
Created by admin on Sat Dec 16 10:09:10 GMT 2023 , Edited by admin on Sat Dec 16 10:09:10 GMT 2023
PRIMARY
CAS
68192-21-2
Created by admin on Sat Dec 16 10:09:10 GMT 2023 , Edited by admin on Sat Dec 16 10:09:10 GMT 2023
PRIMARY
FDA UNII
3JWM4I94Y1
Created by admin on Sat Dec 16 10:09:10 GMT 2023 , Edited by admin on Sat Dec 16 10:09:10 GMT 2023
PRIMARY