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

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4-(methylamino)butanoate

	Properties	Image
MNX_ID	MNXM6103
reference	chebi:66882
formula	C₅H₁₁NO₂
global charge	0
mol weight	117.148
InChIKey	AOKCDAVWJLOAHG-UHFFFAOYSA-N
InChI	InChI=1S/C5H11NO2/c1-6-4-2-3-5(7)8/h6H,2-4H2,1H3,(H,7,8)
SMILES	C[NH2+]CCCC(=O)[O-]

MNX internals

InChI (mnx)	InChI=1/C5H11NO2/c1-6-4-2-3-5(7)8/h6H,2-4H2,1H3,(H,7,8)
SMILES (mnx)	[CH3:1][NH:6][CH2:4][CH2:2][CH2:3][C:5](=[O:7])[OH:8]

Parent-child relations graph

Occurences in reactions	#reac
in my sandbox	0
in MNXref (generic)	6
in models (compartimentalized)	0

Similar chemical compounds in external resources
Identifier	Description
CHEBI:66882 chebi:66882 AOKCDAVWJLOAHG-UHFFFAOYSA-N	4-(methylamino)butanoate 4-(N-methylamino)butyric acid zwitterion 4-(methylamino)butyrate zwitterion 4-(methylamino)butyric acid zwitterion 4-methylaminobutanoate zwitterion 4-methylaminobutanoic acid zwitterion gamma-(methylamino)butyric acid zwitterion
sabiork.compound:28308 sabiorkM:28308 AOKCDAVWJLOAHG-UHFFFAOYSA-M	4-(Methylamino)butyrate
CHEBI:20441 chebi:20441 AOKCDAVWJLOAHG-UHFFFAOYSA-M	4-(methylamino)butyrate 4-(N-methylamino)butyric acid 4-(methylamino)butanoate 4-methylaminobutyrate gamma-methylaminobutyrate
CHEBI:37755 chebi:37755 AOKCDAVWJLOAHG-UHFFFAOYSA-N	4-(methylamino)butyric acid 4-(N-methylamino)butyric acid 4-(methylamino)butanoic acid 4-Methylamino-buttersaeure gamma-N-Methylaminobutyrate gamma-methylaminobutyric acid
envipath:...8642f553283a envipathM:...8642f553283a vmhM:4mabtrt vmhmetabolite:4mabtrt AOKCDAVWJLOAHG-UHFFFAOYSA-M AOKCDAVWJLOAHG-UHFFFAOYSA-N	4-Methylaminobutyrate
seed.compound:cpd14711 seedM:cpd14711 AOKCDAVWJLOAHG-UHFFFAOYSA-N	4-Methylaminobutyrate 4-methylaminobutanoate 4-methylaminobutanoic acid 4-methylaminobutyrate 4-methylaminobutyric acid gamma-N-Methylaminobutyrate gamma-N-methylaminobutyrate
kegg.compound:C15987 keggC:C15987 AOKCDAVWJLOAHG-UHFFFAOYSA-N	4-Methylaminobutyrate gamma-N-Methylaminobutyrate
metacyc.compound:CPD-124 metacycM:CPD-124 AOKCDAVWJLOAHG-UHFFFAOYSA-N	4-methylaminobutanoate 4-methylaminobutanoic acid 4-methylaminobutyrate 4-methylaminobutyric acid gamma-N-methylaminobutyrate
envipath:...73710af0fb1e envipathM:...73710af0fb1e AOKCDAVWJLOAHG-UHFFFAOYSA-M	compound 0062874
keggC:M_C15987 seedM:M_cpd14711 vmhM:M_4mabtrt	secondary/obsolete/fantasy identifier