N-ACETYLISOLEUCINE

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NCATS

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C8H15NO3
Molecular Weight	173.2096
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of N-ACETYLISOLEUCINE

Structure Search

SMILES

CC[C@H](C)[C@H](NC(C)=O)C(O)=O

InChI

InChIKey=JDTWZSUNGHMMJM-FSPLSTOPSA-N

InChI=1S/C8H15NO3/c1-4-5(2)7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)/t5-,7-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C8H15NO3
Molecular Weight	173.2096
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

PubMed

PubMed

Title	Date	PubMed
Structures and properties of a diastereoisomeric molecular compound of (2S,3S)- and (2R,3S)-N-acetyl-2-amino-3-methylpentanoic acids.	2009-10	19809183

Substance Class	Chemical Created by `admin` on `Mon Mar 31 23:00:07 GMT 2025` Edited by `admin` on `Mon Mar 31 23:00:07 GMT 2025`
Record UNII	P9CL0Y0BVZ
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

NSC-203807

Preferred Name

English

N-ACETYLISOLEUCINE

Systematic Name

English

(+)-N-ACETYL-L-ISOLEUCINE

Systematic Name

English

ISOLEUCINE, N-ACETYL-, L-

Systematic Name

English

L-ISOLEUCINE, N-ACETYL-

Systematic Name

English

N-ACETYL-L-ISOLEUCINE

Systematic Name

English

Code System Code Type Description

CHEBI

21555

Created by admin on Mon Mar 31 23:00:07 GMT 2025 , Edited by admin on Mon Mar 31 23:00:07 GMT 2025

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FDA UNII

P9CL0Y0BVZ

Created by admin on Mon Mar 31 23:00:07 GMT 2025 , Edited by admin on Mon Mar 31 23:00:07 GMT 2025

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CHEBI

84056

Created by admin on Mon Mar 31 23:00:07 GMT 2025 , Edited by admin on Mon Mar 31 23:00:07 GMT 2025

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CAS

3077-46-1

Created by admin on Mon Mar 31 23:00:07 GMT 2025 , Edited by admin on Mon Mar 31 23:00:07 GMT 2025

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NSC

203807

Created by admin on Mon Mar 31 23:00:07 GMT 2025 , Edited by admin on Mon Mar 31 23:00:07 GMT 2025

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ECHA (EC/EINECS)

221-364-9

Created by admin on Mon Mar 31 23:00:07 GMT 2025 , Edited by admin on Mon Mar 31 23:00:07 GMT 2025

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PUBCHEM

7036275

Created by admin on Mon Mar 31 23:00:07 GMT 2025 , Edited by admin on Mon Mar 31 23:00:07 GMT 2025

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EPA CompTox

DTXSID101314843

Created by admin on Mon Mar 31 23:00:07 GMT 2025 , Edited by admin on Mon Mar 31 23:00:07 GMT 2025

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