GRAZOPREVIR METABOLITE M-10

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H45N5O8
Molecular Weight	663.7605
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of GRAZOPREVIR METABOLITE M-10

Structure Search

SMILES

COC1=CC2=NC3=C(CCCCC[C@@H]4C[C@H]4OC(=O)N[C@H](C(=O)N5C[C@@H](C[C@H]5C(=O)N[C@@]6(C[C@H]6C=C)C(O)=O)O3)C(C)(C)C)N=C2C=C1

InChI

InChIKey=KBHQXKLVXXJTCO-QBWGSXJWSA-N

InChI=1S/C35H45N5O8/c1-6-20-17-35(20,32(43)44)39-29(41)26-16-22-18-40(26)31(42)28(34(2,3)4)38-33(45)48-27-14-19(27)10-8-7-9-11-24-30(47-22)37-25-15-21(46-5)12-13-23(25)36-24/h6,12-13,15,19-20,22,26-28H,1,7-11,14,16-18H2,2-5H3,(H,38,45)(H,39,41)(H,43,44)/t19-,20-,22-,26+,27-,28-,35-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

GRAZOPREVIR METABOLITE M-10

Common Name

English

(1R,2S)-1-((33R,35S,91R,92R,5S)-5-(TERT-BUTYL)-17-METHOXY-4,7-DIOXO-2,8-DIOXA-6-AZA-1(2,3)-QUINOXALINA-3(3,1)-PYRROLIDINA-9(1,2)-CYCLOPROPANACYCLOTETRADECAPHANE-35-CARBOXAMIDO)-2-VINYLCYCLOPROPANE-1-CARBOXYLIC ACID

Preferred Name

English

Code System Code Type Description

PUBCHEM

156596560

Created by admin on Tue Apr 01 20:28:02 GMT 2025 , Edited by admin on Tue Apr 01 20:28:02 GMT 2025

PRIMARY

FDA UNII

X9Y2H2A8PW

Created by admin on Tue Apr 01 20:28:02 GMT 2025 , Edited by admin on Tue Apr 01 20:28:02 GMT 2025

PRIMARY

PARENT (METABOLITE)