U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C24H28N5O3.Na
Molecular Weight 457.5006
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VALSARTAN MONOSODIUM

SMILES

[Na+].CCCCC(=O)N(CC1=CC=C(C=C1)C2=C(C=CC=C2)C3=NN=NN3)[C@@H](C(C)C)C([O-])=O

InChI

InChIKey=KVPFCQWDTYOLIK-FTBISJDPSA-M
InChI=1S/C24H29N5O3.Na/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23;/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28);/q;+1/p-1/t22-;/m0./s1

HIDE SMILES / InChI

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

Molecular Formula C24H28N5O3
Molecular Weight 434.5108
Charge -1
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:54:53 UTC 2023
Edited
by admin
on Sat Dec 16 18:54:53 UTC 2023
Record UNII
D6XN347U2D
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VALSARTAN MONOSODIUM
Common Name English
L-VALINE, N-(1-OXOPENTYL)-N-((2'-(2H-TETRAZOL-5-YL)(1,1'-BIPHENYL)-4-YL)METHYL)-, SODIUM SALT (1:1)
Systematic Name English
VALSARTAN SODIUM SALT
Common Name English
Code System Code Type Description
PUBCHEM
23682221
Created by admin on Sat Dec 16 18:54:54 UTC 2023 , Edited by admin on Sat Dec 16 18:54:54 UTC 2023
PRIMARY
CAS
1178578-85-2
Created by admin on Sat Dec 16 18:54:54 UTC 2023 , Edited by admin on Sat Dec 16 18:54:54 UTC 2023
NON-SPECIFIC STOICHIOMETRY
CAS
391231-02-0
Created by admin on Sat Dec 16 18:54:54 UTC 2023 , Edited by admin on Sat Dec 16 18:54:54 UTC 2023
PRIMARY
FDA UNII
D6XN347U2D
Created by admin on Sat Dec 16 18:54:54 UTC 2023 , Edited by admin on Sat Dec 16 18:54:54 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY