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Details

Stereochemistry ABSOLUTE
Molecular Formula C25H35NO9
Molecular Weight 493.5467
Optical Activity UNSPECIFIED
Defined Stereocenters 8 / 8
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NATEGLINIDE ACYL GLUCURONIDE

SMILES

CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@H](CC2=CC=CC=C2)C(=O)O[C@@H]3O[C@@H]([C@@H](O)[C@H](O)[C@H]3O)C(O)=O

InChI

InChIKey=YTIRWNSTJVSCRW-BBFBHBGISA-N
InChI=1S/C25H35NO9/c1-13(2)15-8-10-16(11-9-15)22(30)26-17(12-14-6-4-3-5-7-14)24(33)35-25-20(29)18(27)19(28)21(34-25)23(31)32/h3-7,13,15-21,25,27-29H,8-12H2,1-2H3,(H,26,30)(H,31,32)/t15-,16-,17-,18+,19+,20-,21+,25+/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H35NO9
Molecular Weight 493.5467
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 8 / 8
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 22:26:53 GMT 2025
Edited
by admin
on Tue Apr 01 22:26:53 GMT 2025
Record UNII
QQX94P5FVU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2S,3S,4S,5R,6S)-3,4,5-TRIHYDROXY-6-((2R)-2-((4-ISOPROPYLCYCLOHEXANECARBONYL)AMINO)-3-PHENYL-PROPANOYL)OXY-TETRAHYDROPYRAN-2-CARBOXYLIC ACID
Preferred Name English
NATEGLINIDE ACYL GLUCURONIDE
Common Name English
.BETA.-D-GLUCOPYRANURONIC ACID, 1-ESTER WITH N-((TRANS-4-(1-METHYLETHYL)CYCLOHEXYL)CARBONYL)-D-PHENYLALANINE
Systematic Name English
Code System Code Type Description
FDA UNII
QQX94P5FVU
Created by admin on Tue Apr 01 22:26:53 GMT 2025 , Edited by admin on Tue Apr 01 22:26:53 GMT 2025
PRIMARY
CAS
183996-85-2
Created by admin on Tue Apr 01 22:26:53 GMT 2025 , Edited by admin on Tue Apr 01 22:26:53 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> METABOLITE
CYP2C metabolizes at 70% and CYP3A4 at 30%.