3-METHYLLANTHIONINE, (2S,3S,6R)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C7H14N2O4S
Molecular Weight	222.262
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-METHYLLANTHIONINE, (2S,3S,6R)-

Structure Search

SMILES

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

InChI

InChIKey=NSGOABPZARPCFM-VAYJURFESA-N

InChI=1S/C7H14N2O4S/c1-3(5(9)7(12)13)14-2-4(8)6(10)11/h3-5H,2,8-9H2,1H3,(H,10,11)(H,12,13)/t3-,4-,5+/m0/s1

HIDE SMILES / InChI

Molecular Formula	C7H14N2O4S
Molecular Weight	222.262
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	3 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:53:41 GMT 2025` Edited by `admin` on `Tue Apr 01 18:53:41 GMT 2025`
Record UNII	MZ6AHU9TAO
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-METHYLLANTHIONINE, (2S,3S,6R)-

Common Name

English

J174.792D

Preferred Name

English

(2S,3S)-2-AMINO-3-(((2R)-2-AMINO-2-CARBOXYETHYL)THIO)BUTYRIC ACID

Systematic Name

English

(2S,3S)-2-AMINO-3-((2R)-2-AMINO-2-CARBOXYETHYL)SULFANYLBUTANOIC ACID

Systematic Name

English

BUTANOIC ACID, 2-AMINO-3-(((2R)-2-AMINO-2-CARBOXYETHYL)THIO)-, (2S,3S)-

Systematic Name

English

(2S,3S,6R)-2,6-DIAMINO-3-METHYL-4-THIAHEPTANEDIOIC ACID

Systematic Name

English

(2S,3S)-2-AMINO-3-((2R)-2-AMINO-3-HYDROXY-3-OXOPROPYL)SULFANYLBUTANOIC ACID

Systematic Name

English

(2S,3S,6R)-3-METHYLLANTHIONINE

Common Name

English

(2S,3S,2'R)-.BETA.-METHYLLANTHIONINE

Common Name

English

Code System Code Type Description

PUBCHEM

191096

Created by admin on Tue Apr 01 18:53:41 GMT 2025 , Edited by admin on Tue Apr 01 18:53:41 GMT 2025

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FDA UNII

MZ6AHU9TAO

Created by admin on Tue Apr 01 18:53:41 GMT 2025 , Edited by admin on Tue Apr 01 18:53:41 GMT 2025

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CAS

42849-28-5

Created by admin on Tue Apr 01 18:53:41 GMT 2025 , Edited by admin on Tue Apr 01 18:53:41 GMT 2025

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EPA CompTox

DTXSID70195533

Created by admin on Tue Apr 01 18:53:41 GMT 2025 , Edited by admin on Tue Apr 01 18:53:41 GMT 2025

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