DESMETHYL-VELPATASVIR

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C48H52N8O8
Molecular Weight	868.9753
Optical Activity	UNSPECIFIED
Defined Stereocenters	6 / 6
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

COC(=O)N[C@@H](C(C)C)C(=O)N1[C@@H](C)CC[C@H]1C2=NC3=C(N2)C4=C(C=C3)C=C5C(OCC6=CC(=CC=C56)C7=CN=C(N7)[C@@H]8C[C@H](CO)CN8C(=O)[C@H](NC(=O)OC)C9=CC=CC=C9)=C4

InChI

InChIKey=BWMQSUSKFWWQJQ-ZSMILFTGSA-N

InChI=1S/C48H52N8O8/c1-25(2)40(53-47(60)62-4)46(59)56-26(3)11-16-37(56)44-50-35-15-13-29-19-34-32-14-12-30(18-31(32)24-64-39(34)20-33(29)42(35)52-44)36-21-49-43(51-36)38-17-27(23-57)22-55(38)45(58)41(54-48(61)63-5)28-9-7-6-8-10-28/h6-10,12-15,18-21,25-27,37-38,40-41,57H,11,16-17,22-24H2,1-5H3,(H,49,51)(H,50,52)(H,53,60)(H,54,61)/t26-,27-,37-,38-,40-,41+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

DESMETHYL-VELPATASVIR

Common Name

English

DESMETHYL-VEL

Common Name

English

VELPATASVIR METABOLITE M-19

Common Name

English

CARBAMIC ACID, N-((1S)-1-(((2S,5S)-2-(1,11-DIHYDRO-9-(2-((2S,4S)-4-(HYDROXYMETHYL)-1-((2R)-2-((METHOXYCARBONYL)AMINO)-2-PHENYLACETYL)-2-PYRROLIDINYL)-1H-IMIDAZOL-5-YL)(2)BENZOPYRANO(4',3':6,7)NAPHTH(1,2-D)IMIDAZOL-2-YL)-5-METHYL-1-PYRROLIDINYL)CARBONYL)-

Systematic Name

English

Code System Code Type Description

FDA UNII

ZT4QPD8LUB

Created by admin on Sat Dec 16 13:33:26 GMT 2023 , Edited by admin on Sat Dec 16 13:33:26 GMT 2023

PRIMARY

CAS

2171136-71-1

Created by admin on Sat Dec 16 13:33:26 GMT 2023 , Edited by admin on Sat Dec 16 13:33:26 GMT 2023

PRIMARY

PUBCHEM