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Details

Stereochemistry ABSOLUTE
Molecular Formula C38H49N5O4
Molecular Weight 639.8282
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

SMILES

CC(C)[C@@]([H])(C(=O)N1CCC[C@@]1([H])C(=O)Nc2ccc(cc2)[C@]3([H])CC[C@@]([H])(c4ccc(cc4)N)N3c5ccc(cc5)C(C)(C)C)N=C(O)OC

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

Molecular Formula C38H49N5O4
Molecular Weight 639.8282
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 4 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Fri Jun 25 23:19:25 UTC 2021
Edited
by admin
on Fri Jun 25 23:19:25 UTC 2021
Record UNII
NOD2OGX1NF
Record Status Validated (UNII)
Record Version
  • Download
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 Fri Jun 25 23:19:25 UTC 2021 , Edited by admin on Fri Jun 25 23:19:25 UTC 2021
PRIMARY
CAS
1258230-98-6
Created by admin on Fri Jun 25 23:19:25 UTC 2021 , Edited by admin on Fri Jun 25 23:19:25 UTC 2021
PRIMARY
PUBCHEM
49846541
Created by admin on Fri Jun 25 23:19:25 UTC 2021 , Edited by admin on Fri Jun 25 23:19:25 UTC 2021
PRIMARY
Related Record Type Details
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