**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

Feedback

allocystathionine

MNXM319 is deprecated and here replaced by MNXM1372131
!!! Alternative mappings exist !!!

Properties

Image

with InChI numbering

Occurences in reactions

MNX_ID

MNXM1372131

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₇H₁₄N₂O₄S

charge

mass

222.259

reference

InChIKey

ILRYLPWNYFXEMH-ROLXFIACSA-N

InChI

InChI=1S/C7H14N2O4S/c8-4(6(10)11)1-2-14-3-5(9)7(12)13/h4-5H,1-3,8-9H2,(H,10,11)(H,12,13)/t4-,5?/m0/s1

SMILES

[CH2:1]([CH2:2][S:14][CH2:3][CH:5]([C:7](=[O:12])[OH:13])[NH2:9])[C@@H:4]([C:6](=[O:10])[OH:11])[NH2:8]

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:165853 chebi:165853	allocystathionine (2S)-2-amino-4-(2-amino-2-carboxyethyl)sulanylbutanoic acid
hmdb:HMDB0000455	Allocystathionine (2S)-2-Amino-4-[(2-amino-2-carboxyethyl)sulfanyl]butanoate (2S)-2-Amino-4-[(2-amino-2-carboxyethyl)sulphanyl]butanoate (2S)-2-Amino-4-[(2-amino-2-carboxyethyl)sulphanyl]butanoic acid (2S)-2-amino-4-[(2-amino-2-carboxyethyl)sulfanyl]butanoic acid DL-Allocystathionine DL-S-(2-Amino-2-carboxyethyl)-homocysteine a-Amino-g-(2-amino-2-carboxyethylmercapto)-butyric acid alpha-Amino-gamma-(2-amino-2-carboxyethylmercapto)-butyric acid
hmdb:HMDB00455	secondary/obsolete/fantasy identifier