N-(METHOXYCARBONYL)-L-VALYL-N-(4-((2S,5S)-5-(4-AMINOPHENYL)-1-(4-(1,1-DIMETHYLETHYL)PHENYL)-2-PYRROLIDINYL)PHENYL)-L-PROLINAMIDE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C38H49N5O4
Molecular Weight	639.8268
Optical Activity	UNSPECIFIED
Defined Stereocenters	4 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-(METHOXYCARBONYL)-L-VALYL-N-(4-((2S,5S)-5-(4-AMINOPHENYL)-1-(4-(1,1-DIMETHYLETHYL)PHENYL)-2-PYRROLIDINYL)PHENYL)-L-PROLINAMIDE

Structure Search

SMILES

COC(=O)N[C@@H](C(C)C)C(=O)N1CCC[C@H]1C(=O)NC2=CC=C(C=C2)[C@@H]3CC[C@H](N3C4=CC=C(C=C4)C(C)(C)C)C5=CC=C(N)C=C5

InChI

InChIKey=YPPREFKHYZULNS-CUPIEXAXSA-N

InChI=1S/C38H49N5O4/c1-24(2)34(41-37(46)47-6)36(45)42-23-7-8-33(42)35(44)40-29-17-11-26(12-18-29)32-22-21-31(25-9-15-28(39)16-10-25)43(32)30-19-13-27(14-20-30)38(3,4)5/h9-20,24,31-34H,7-8,21-23,39H2,1-6H3,(H,40,44)(H,41,46)/t31-,32-,33-,34-/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

N-(METHOXYCARBONYL)-L-VALYL-N-(4-((2S,5S)-5-(4-AMINOPHENYL)-1-(4-(1,1-DIMETHYLETHYL)PHENYL)-2-PYRROLIDINYL)PHENYL)-L-PROLINAMIDE

Systematic Name

English

L-PROLINAMIDE, N-(METHOXYCARBONYL)-L-VALYL-N-(4-((2S,5S)-5-(4-AMINOPHENYL)-1-(4-(1,1-DIMETHYLETHYL)PHENYL)-2-PYRROLIDINYL)PHENYL)-

Systematic Name

English

OMBITASVIR METABOLITE M6

Common Name

English

Code System Code Type Description

FDA UNII

NOD2OGX1NF

Created by admin on Sat Dec 16 14:53:46 GMT 2023 , Edited by admin on Sat Dec 16 14:53:46 GMT 2023

PRIMARY

CAS

1258230-98-6

Created by admin on Sat Dec 16 14:53:46 GMT 2023 , Edited by admin on Sat Dec 16 14:53:46 GMT 2023

PRIMARY

PUBCHEM

49846541

Created by admin on Sat Dec 16 14:53:46 GMT 2023 , Edited by admin on Sat Dec 16 14:53:46 GMT 2023

PRIMARY

PARENT (METABOLITE)


					2302768XJ8

OMBITASVIR

SUBSTANCE RECORD


					NOD2OGX1NF

N-(METHOXYCARBONYL)-L-VALYL-N-(4-((2S,5S)-5-(4-AMINOPHENYL)-1-(4-(1,1-DIMETHYLETHYL)PHENYL)-2-PYRROLIDINYL)PHENYL)-L-PROLINAMIDE