O-ACETYLTHREONINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C6H11NO4
Molecular Weight	161.1558
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H](OC(C)=O)[C@H](N)C(O)=O

InChI

InChIKey=GOVSRIMJZNIFHS-WUJLRWPWSA-N

InChI=1S/C6H11NO4/c1-3(11-4(2)8)5(7)6(9)10/h3,5H,7H2,1-2H3,(H,9,10)/t3-,5+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C6H11NO4
Molecular Weight	161.1558
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 `Mon Mar 31 21:02:13 GMT 2025` Edited by `admin` on `Mon Mar 31 21:02:13 GMT 2025`
Record UNII	I5ABK2S28W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

O-ACETYLTHREONINE

Systematic Name

English

H-THR(AC)-OH

Preferred Name

English

L-THREONINE, O-ACETYL-

Systematic Name

English

L-THREONIUM ACETATE

Systematic Name

English

THREONINE, ACETATE (ESTER), L-

Systematic Name

English

Code System Code Type Description

PUBCHEM

16718064

Created by admin on Mon Mar 31 21:02:13 GMT 2025 , Edited by admin on Mon Mar 31 21:02:13 GMT 2025

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CAS

17012-42-9

Created by admin on Mon Mar 31 21:02:13 GMT 2025 , Edited by admin on Mon Mar 31 21:02:13 GMT 2025

PRIMARY

EPA CompTox

DTXSID40587325

Created by admin on Mon Mar 31 21:02:13 GMT 2025 , Edited by admin on Mon Mar 31 21:02:13 GMT 2025

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FDA UNII

I5ABK2S28W

Created by admin on Mon Mar 31 21:02:13 GMT 2025 , Edited by admin on Mon Mar 31 21:02:13 GMT 2025

PRIMARY