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Details

Stereochemistry EPIMERIC
Molecular Formula C22H29N4O7S.Na
Molecular Weight 516.543
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 4
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Olgotrelvir Sodium

SMILES

[Na+].CC(C)C[C@H](NC(=O)C1=CC2=CC=CC=C2N1)C(=O)N[C@@H](C[C@@H]3CCNC3=O)C(O)S([O-])(=O)=O

InChI

InChIKey=WEMYKLGDWNXOBX-MMUJOADSSA-M
InChI=1S/C22H30N4O7S.Na/c1-12(2)9-16(25-21(29)17-10-13-5-3-4-6-15(13)24-17)20(28)26-18(22(30)34(31,32)33)11-14-7-8-23-19(14)27;/h3-6,10,12,14,16,18,22,24,30H,7-9,11H2,1-2H3,(H,23,27)(H,25,29)(H,26,28)(H,31,32,33);/q;+1/p-1/t14-,16-,18-,22?;/m0./s1

HIDE SMILES / InChI

Molecular Formula C22H29N4O7S
Molecular Weight 493.553
Charge -1
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 3 / 4
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 19:29:07 GMT 2023
Edited
by admin
on Sat Dec 16 19:29:07 GMT 2023
Record UNII
P6R34G4NQQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Olgotrelvir Sodium
USAN  
Official Name English
Sodium (2S)-2-((S)-2-(1H-indole-2-carboxamido)-4-methylpentanamido)-1-hydroxy-3-((S)-2-oxopyrrolidin-3-yl) propane-1-sulfonate
Systematic Name English
OLGOTRELVIR SODIUM [USAN]
Common Name English
3-Pyrrolidinepropanesulfonic acid, α-hydroxy-β-[[(2S)-2-[(1H-indol-2-ylcarbonyl)amino]-4-methyl-1-oxopentyl]amino]-2-oxo-, sodium salt (1:1), (βS,3S)-
Systematic Name English
Code System Code Type Description
PUBCHEM
166157330
Created by admin on Sat Dec 16 19:29:08 GMT 2023 , Edited by admin on Sat Dec 16 19:29:08 GMT 2023
PRIMARY
USAN
LM-12
Created by admin on Sat Dec 16 19:29:08 GMT 2023 , Edited by admin on Sat Dec 16 19:29:08 GMT 2023
PRIMARY
CAS
2763596-72-9
Created by admin on Sat Dec 16 19:29:08 GMT 2023 , Edited by admin on Sat Dec 16 19:29:08 GMT 2023
PRIMARY
FDA UNII
P6R34G4NQQ
Created by admin on Sat Dec 16 19:29:08 GMT 2023 , Edited by admin on Sat Dec 16 19:29:08 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE