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

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L-allo-threonine

	Properties	Image
MNX_ID	MNXM2125
reference	chebi:58585
formula	C₄H₉NO₃
global charge	0
mol weight	119.12
InChIKey	AYFVYJQAPQTCCC-HRFVKAFMSA-N
InChI	InChI=1S/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m0/s1
SMILES	C[C@H](O)[C@H]([NH3+])C(=O)[O-]

MNX internals

InChI (mnx)	InChI=1/C4H9NO3/c1-2(6)3(5)4(7)8/h2-3,6H,5H2,1H3,(H,7,8)/t2-,3-/m0/s1
SMILES (mnx)	[CH3:1][C@@H:2]([C@@H:3]([C:4](=[O:7])[OH:8])[NH2:5])[OH:6]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	5

Similar chemical compounds in external resources
Identifier	Description
CHEBI:58585 chebi:58585 AYFVYJQAPQTCCC-HRFVKAFMSA-N	L-allo-threonine (2S,3S)-2-ammonio-3-hydroxybutanoate L-allothreonine zwitterion
bigg.metabolite:athr__L biggM:athr__L	L-Allo-threonine
vmhM:athr_L vmhmetabolite:athr_L AYFVYJQAPQTCCC-HRFVKAFMSA-N	L-Allo-threonine (2S,3S)-2-amino-3-hydroxybutanoic acid
hmdb:HMDB0004041 AYFVYJQAPQTCCC-HRFVKAFMSA-N	L-Allothreonine (2S,3S)-2-Amino-3-hydroxybutanoate (2S,3S)-2-Amino-3-hydroxybutanoic acid (2S,3S)-2-amino-3-hydroxybutanoic acid ALLO-threonine Allo-L-threonine D-Allothreonine L-Allo-threonine L-allothreonine
seed.compound:cpd03282 seedM:cpd03282 AYFVYJQAPQTCCC-HRFVKAFMSA-N	L-Allothreonine L-Allo-threonine L-allo-Threonine L-allo-threonine thr-LA
kegg.compound:C05519 keggC:C05519 AYFVYJQAPQTCCC-HRFVKAFMSA-N	L-Allothreonine L-allo-Threonine
sabiork.compound:2793 sabiorkM:2793 AYFVYJQAPQTCCC-HRFVKAFMSA-N	L-allo-Threonine L-Allothreonine
metacyc.compound:L-ALLO-THREONINE metacycM:L-ALLO-THREONINE AYFVYJQAPQTCCC-HRFVKAFMSA-N	L-allo-threonine
CHEBI:28718 chebi:28718 AYFVYJQAPQTCCC-HRFVKAFMSA-N	L-allothreonine (2S,3S)-2-amino-3-hydroxybutanoic acid ALLO-THREONINE L-Allothreonine L-allo-Threonine allo-L-threonine
sabiork.compound:21308 sabiorkM:21308 AYFVYJQAPQTCCC-HRFVKAFMSA-N	allo-Threonine
CHEBI:38262 chebi:38262	allothreonine rel-(2R,3R)-2-amino-3-hydroxybutanoic acid
hmdb:HMDB04041 chebi:21221 chebi:40698 chebi:6174 biggM:M_athr__L keggC:M_C05519 seedM:M_cpd03282 vmhM:M_athr_L	secondary/obsolete/fantasy identifier