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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H25NO5
Molecular Weight 383.4376
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SACUBITRILAT

SMILES

C[C@H](C[C@@H](CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)CCC(O)=O)C(O)=O

InChI

InChIKey=DOBNVUFHFMVMDB-BEFAXECRSA-N
InChI=1S/C22H25NO5/c1-15(22(27)28)13-19(23-20(24)11-12-21(25)26)14-16-7-9-18(10-8-16)17-5-3-2-4-6-17/h2-10,15,19H,11-14H2,1H3,(H,23,24)(H,25,26)(H,27,28)/t15-,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula C22H25NO5
Molecular Weight 383.4376
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 04:18:38 UTC 2023
Edited
by admin
on Sat Dec 16 04:18:38 UTC 2023
Record UNII
SPI5PBF81S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SACUBITRILAT
INN   WHO-DD  
INN  
Official Name English
(2R,4S)-5-(BIPHENYL-4-YL)-4-((3-CARBOXYPROPIONYL)AMINO)-2-METHYLPENTANOIC ACID
Systematic Name English
LBQ657
Code English
SACUBITRILAT [MI]
Common Name English
sacubitrilat [INN]
Common Name English
Sacubitrilat [WHO-DD]
Common Name English
LBQ-657
Code English
Classification Tree Code System Code
NDF-RT N0000191728
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
NCI_THESAURUS C270
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
Code System Code Type Description
SMS_ID
300000034430
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
NDF-RT
N0000191727
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY Neprilysin Inhibitors [MoA]
CAS
149709-44-4
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
NCI_THESAURUS
C152282
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
PUBCHEM
10430040
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
FDA UNII
SPI5PBF81S
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
DAILYMED
SPI5PBF81S
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
RXCUI
1860608
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
INN
10110
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
DRUG BANK
DB14127
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
MERCK INDEX
m11857
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
EPA CompTox
DTXSID10164369
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
WIKIPEDIA
Sacubitrilat
Created by admin on Sat Dec 16 04:18:38 UTC 2023 , Edited by admin on Sat Dec 16 04:18:38 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
PRODRUG -> METABOLITE ACTIVE
Related Record Type Details
ACTIVE MOIETY