Sacubitril, (2S,4S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C24H29NO5
Molecular Weight	411.4908
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

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

InChI

InChIKey=PYNXFZCZUAOOQC-UWJYYQICSA-N

InChI=1S/C24H29NO5/c1-3-30-24(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/h4-12,17,21H,3,13-16H2,1-2H3,(H,25,26)(H,27,28)/t17-,21-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C24H29NO5
Molecular Weight	411.4908
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 19:50:12 UTC 2023` Edited by `admin` on `Sat Dec 16 19:50:12 UTC 2023`
Record UNII	UTU8FGY2BV
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Sacubitril, (2S,4S)-

Common Name

English

[1,1′-Biphenyl]-4-pentanoic acid, γ-[(3-carboxy-1-oxopropyl)amino]-α-methyl-, α-ethyl ester, (αS,γS)-

Systematic Name

English

[1,1′-Biphenyl]-4-pentanoic acid, γ-[(3-carboxy-1-oxopropyl)amino]-α-methyl-, ethyl ester, [S-(R*,R*)]-

Systematic Name

English

α-Ethyl (αS,γS)-γ-[(3-carboxy-1-oxopropyl)amino]-α-methyl[1,1′-biphenyl]-4-pentanoate

Systematic Name

English

(2S,4S)-Sacubitril

Common Name

English

Sacubitril-(2S,4S)-Isomer calcium salt

Common Name

English

Sacubitril (SS) diastereomer

Common Name

English

Code System Code Type Description

FDA UNII

UTU8FGY2BV

Created by admin on Sat Dec 16 19:50:12 UTC 2023 , Edited by admin on Sat Dec 16 19:50:12 UTC 2023

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CAS

149709-63-7

Created by admin on Sat Dec 16 19:50:12 UTC 2023 , Edited by admin on Sat Dec 16 19:50:12 UTC 2023

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PUBCHEM

122172973

Created by admin on Sat Dec 16 19:50:12 UTC 2023 , Edited by admin on Sat Dec 16 19:50:12 UTC 2023

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