DES-(METHYLCYCLOPROPYLSULFONAMIDE)-GLECAPREVIR

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C34H39F4N5O8
Molecular Weight	721.6958
Optical Activity	UNSPECIFIED
Defined Stereocenters	7 / 7
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DES-(METHYLCYCLOPROPYLSULFONAMIDE)-GLECAPREVIR

Structure Search

SMILES

[H][C@@]12C[C@H](N(C1)C(=O)[C@@H](NC(=O)O[C@]3([H])CCC[C@@]3([H])OC\C=C\C(F)(F)C4=NC5=CC=CC=C5N=C4O2)C(C)(C)C)C(=O)N[C@@]6(C[C@H]6C(F)F)C(O)=O

InChI

InChIKey=BZFLXXVDNIKPLZ-PPXQBHTISA-N

InChI=1S/C34H39F4N5O8/c1-32(2,3)25-29(45)43-16-17(14-21(43)27(44)42-33(30(46)47)15-18(33)26(35)36)50-28-24(39-19-8-4-5-9-20(19)40-28)34(37,38)12-7-13-49-22-10-6-11-23(22)51-31(48)41-25/h4-5,7-9,12,17-18,21-23,25-26H,6,10-11,13-16H2,1-3H3,(H,41,48)(H,42,44)(H,46,47)/b12-7+/t17-,18+,21+,22-,23-,25-,33-/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

DES-(METHYLCYCLOPROPYLSULFONAMIDE)-GLECAPREVIR

Common Name

English

GLECAPREVIR METABOLITE M6

Common Name

English

(1R,2R)-1-((33R,35S,91R,92R,5S,E)-5-(TERT-BUTYL)-14,14-DIFLUORO-4,7-DIOXO-2,8,10-TRIOXA-6-AZA-1(2,3)-QUINOXALINA-3(3,1)-PYRROLIDINA-9(1,2)-CYCLOPENTANACYCLOTETRADECAPHAN-12-ENE-35-CARBOXAMIDO)-2-(DIFLUOROMETHYL)CYCLOPROPANE-1-CARBOXYLIC ACID

Systematic Name

English

Code System Code Type Description

PUBCHEM

146019611

Created by admin on Sat Dec 16 14:02:33 GMT 2023 , Edited by admin on Sat Dec 16 14:02:33 GMT 2023

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FDA UNII

OTN2X0KR7L

Created by admin on Sat Dec 16 14:02:33 GMT 2023 , Edited by admin on Sat Dec 16 14:02:33 GMT 2023

PRIMARY

PARENT (METABOLITE)