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Details

Stereochemistry ABSOLUTE
Molecular Formula C36H38N2O13
Molecular Weight 706.6925
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PELIGLITAZAR ACYL-BETA-D-GLUCURONIDE

SMILES

COC1=CC=C(OC(=O)N(CC(=O)O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O)[C@@H](C)C3=CC=C(OCCC4=C(C)OC(=N4)C5=CC=CC=C5)C=C3)C=C1

InChI

InChIKey=RRDHVAGAEOKAQO-HKBAUFCZSA-N
InChI=1S/C36H38N2O13/c1-20(22-9-11-25(12-10-22)47-18-17-27-21(2)48-33(37-27)23-7-5-4-6-8-23)38(36(45)49-26-15-13-24(46-3)14-16-26)19-28(39)50-35-31(42)29(40)30(41)32(51-35)34(43)44/h4-16,20,29-32,35,40-42H,17-19H2,1-3H3,(H,43,44)/t20-,29-,30-,31+,32-,35+/m0/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
PELIGLITAZAR ACYL-BETA-D-GLUCURONIDE
Common Name English
(2S,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-(2-((4-METHOXYPHENOXY)CARBONYL-((1S)-1-(4-(2-(5-METHYL-2-PHENYL-OXAZOL-4-YL)ETHOXY)PHENYL)ETHYL)AMINO)ACETYL)OXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID
Systematic Name English
ACYL GLUCURONIDE PELIGLITAZAR
Common Name English
PELIGLITAZAR METABOLITE M14
Common Name English
Code System Code Type Description
PUBCHEM
118753235
Created by admin on Sat Dec 16 16:42:07 GMT 2023 , Edited by admin on Sat Dec 16 16:42:07 GMT 2023
PRIMARY
CAS
1807894-91-2
Created by admin on Sat Dec 16 16:42:07 GMT 2023 , Edited by admin on Sat Dec 16 16:42:07 GMT 2023
PRIMARY
FDA UNII
AW7V6IN2BW
Created by admin on Sat Dec 16 16:42:07 GMT 2023 , Edited by admin on Sat Dec 16 16:42:07 GMT 2023
PRIMARY