MetaNetX
Automated Model Construction and Genome Annotation for Large-Scale Metabolic Networks

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(3S)-3-hydroxy-L-aspartate

	Properties	Image
MNX_ID	MNXM4918
reference	chebi:57251
formula	C₄H₆NO₅
global charge	-1
mol weight	148.094
InChIKey	YYLQUHNPNCGKJQ-LWMBPPNESA-M
InChI	InChI=1S/C4H7NO5/c5-1(3(7)8)2(6)4(9)10/h1-2,6H,5H2,(H,7,8)(H,9,10)/p-1/t1-,2-/m0/s1
SMILES	[NH3+][C@H](C(=O)[O-])[C@H](O)C(=O)[O-]

MNX internals

InChI (mnx)	InChI=1/C4H7NO5/c5-1(3(7)8)2(6)4(9)10/h1-2,6H,5H2,(H,7,8)(H,9,10)/t1-,2-/m0/s1
SMILES (mnx)	[C@H:1]([C@@H:2]([C:4](=[O:9])[OH:10])[OH:6])([C:3](=[O:7])[OH:8])[NH2:5]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	1

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57251 chebi:57251 YYLQUHNPNCGKJQ-LWMBPPNESA-M	(3S)-3-hydroxy-L-aspartate (2S,3S)-2-azaniumyl-3-hydroxybutanedioate (3S)-3-hydroxy-L-aspartate(1-)
CHEBI:17838 chebi:17838 YYLQUHNPNCGKJQ-LWMBPPNESA-L	(3S)-3-hydroxy-L-aspartate(2-) (2S,3S)-2-amino-3-hydroxybutanedioate (3S)-3-hydroxy-L-aspartate
metacyc.compound:THREO-3-HYDROXY-L-ASPARTATE metacycM:THREO-3-HYDROXY-L-ASPARTATE YYLQUHNPNCGKJQ-LWMBPPNESA-M	(3S)-3-hydroxy-L-aspartate L-threo-3-hydroxyaspartate L-threo-beta-hydroxyaspartate threo-3-hydroxy-L-aspartate
CHEBI:10696 chebi:10696 YYLQUHNPNCGKJQ-LWMBPPNESA-N	(3S)-3-hydroxy-L-aspartic acid (2S,3S)-2-amino-3-hydroxybutanedioic acid DL-threo-beta-Hydroxyaspartic acid
seed.compound:cpd08350 seedM:cpd08350 YYLQUHNPNCGKJQ-LWMBPPNESA-M	L-threo-3-Hydroxyaspartate (3S)-3-hydroxy-L-aspartate L-threo-3-hydroxyaspartate L-threo-beta-hydroxyaspartate threo-3-Hydroxy-L-aspartate threo-3-hydroxy-L-aspartate
envipath:...0fb103561f6f envipathM:...0fb103561f6f YYLQUHNPNCGKJQ-LWMBPPNESA-L	compound 0070266
vmhM:t3hasp vmhmetabolite:t3hasp YYLQUHNPNCGKJQ-LWMBPPNESA-N	threo-3-Hydroxy-L-aspartate
sabiork.compound:13576 sabiorkM:13576 kegg.compound:C11511 keggC:C11511 YYLQUHNPNCGKJQ-LWMBPPNESA-N	threo-3-Hydroxy-L-aspartate L-threo-3-Hydroxyaspartate
chebi:12852 keggC:M_C11511 seedM:M_cpd08350 vmhM:M_t3hasp	secondary/obsolete/fantasy identifier