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Details

Stereochemistry ABSOLUTE
Molecular Formula 2C24H28NO5.2C24H27N5O3.6Na.5H2O
Molecular Weight 1915.9901
Optical Activity UNSPECIFIED
Defined Stereocenters 6 / 6
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SACUBITRIL VALSARTAN SODIUM HYDRATE

SMILES

CCCCC(=O)N(Cc1ccc(cc1)-c2ccccc2-c3nnn[n-]3)[C@@H](C(C)C)C(=O)[O-].CCCCC(=O)N(Cc1ccc(cc1)-c2ccccc2-c3nnn[n-]3)[C@@H](C(C)C)C(=O)[O-].CCOC(=O)[C@H](C)C[C@@H](Cc1ccc(cc1)-c2ccccc2)NC(=O)CCC(=O)[O-].CCOC(=O)[C@H](C)C[C@@H](Cc1ccc(cc1)-c2ccccc2)NC(=O)CCC(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].O.O.O.O.O

InChI

InChIKey=ZASXKEGREHRXDL-CAWNUZPDSA-H
InChI=1S/2C24H29N5O3.2C24H29NO5.6Na.5H2O/c2*1-4-5-10-21(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;2*1-3-30-24(29)17(2)15-21(25-22(26)13-14-23(27)28)16-18-9-11-20(12-10-18)19-7-5-4-6-8-19;;;;;;;;;;;/h2*6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H2,25,26,27,28,31,32);2*4-12,17,21H,3,13-16H2,1-2H3,(H,25,26)(H,27,28);;;;;;;5*1H2/q;;;;6*+1;;;;;/p-6/t2*22-;2*17-,21+;;;;;;;;;;;/m0011.........../s1

HIDE SMILES / InChI

Molecular Formula C24H29N5O3
Molecular Weight 435.5197
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
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

Molecular Formula C24H29NO5
Molecular Weight 411.4917
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula HO
Molecular Weight 17.0073
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 Fri Jun 25 23:02:42 UTC 2021
Edited
by admin
on Fri Jun 25 23:02:42 UTC 2021
Record UNII
WB8FT61183
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SACUBITRIL VALSARTAN SODIUM HYDRATE
JAN   WHO-DD  
Common Name English
VALSARTAN AHU-377 SODIUM HEMIPENTAHYDRATE
Common Name English
SACUBITRIL VALSARTAN SODIUM HYDRATE [JAN]
Common Name English
SUCABITRIL VALSARTAN SODIUM HYDRATE
Common Name English
SACUBITRIL VALSARTAN SODIUM HYDRATE [WHO-DD]
Common Name English
ENTRESTO
Brand Name English
L-VALINE, N-(1-OXOPENTYL)-N-((2'-(2H-TETRAZOL-5-YL)(1,1'-BIPHENYL)-4-YL)METHYL)-, COMPD. WITH .ALPHA.-ETHYL (.ALPHA.R,.GAMMA.S)-.GAMMA.-((3-CARBOXY-1-OXOPROPYL)AMINO)-.ALPHA.-METHYL(1,1'-BIPHENYL)-4-PENTANOATE, SODIUM SALT, HYDRATE (2:2:6:5)
Common Name English
LCZ696
Code English
LCZ-696
Code English
Code System Code Type Description
EPA CompTox
936623-90-4
Created by admin on Fri Jun 25 23:02:42 UTC 2021 , Edited by admin on Fri Jun 25 23:02:42 UTC 2021
PRIMARY
EVMPD
SUB171905
Created by admin on Fri Jun 25 23:02:42 UTC 2021 , Edited by admin on Fri Jun 25 23:02:42 UTC 2021
PRIMARY
FDA UNII
WB8FT61183
Created by admin on Fri Jun 25 23:02:42 UTC 2021 , Edited by admin on Fri Jun 25 23:02:42 UTC 2021
PRIMARY
EVMPD
SUB183754
Created by admin on Fri Jun 25 23:02:42 UTC 2021 , Edited by admin on Fri Jun 25 23:02:42 UTC 2021
PRIMARY
PUBCHEM
71449007
Created by admin on Fri Jun 25 23:02:42 UTC 2021 , Edited by admin on Fri Jun 25 23:02:42 UTC 2021
PRIMARY
CAS
936623-90-4
Created by admin on Fri Jun 25 23:02:42 UTC 2021 , Edited by admin on Fri Jun 25 23:02:42 UTC 2021
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY
ACTIVE MOIETY