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2-methylaspartate

PropertiesImage
MNX_IDMNXM89498 Image of MNXM89498
referencemetacycM:CPD0-1614
formulaC5H8NO4
global charge-1
mol weight146.122
InChIKeyCWAYDJFPMMUKOI-UHFFFAOYSA-M
InChIInChI=1S/C5H9NO4/c1-5(6,4(9)10)2-3(7)8/h2,6H2,1H3,(H,7,8)(H,9,10)/p-1
SMILESCC([NH3+])(CC(=O)[O-])C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C5H9NO4/c1-5(6,4(9)10)2-3(7)8/h2,6H2,1H3,(H,7,8)(H,9,10)/t5? Image of MNXM89498
SMILES (mnx)[CH3:1][C:5]([CH2:2][C:3](=[O:7])[OH:8])([C:4](=[O:9])[OH:10])[NH2:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD0-1614
metacycM:CPD0-1614
seed.compound:cpd26248
seedM:cpd26248
CWAYDJFPMMUKOI-UHFFFAOYSA-M
2-methylaspartate
alpha-methyl-DL-aspartate

sabiork.compound:21128
sabiorkM:21128
CWAYDJFPMMUKOI-UHFFFAOYSA-N
2-Methylaspartic acid

seed.compound:cpd28823
seedM:cpd28823
2-methylaspartate

seedM:M_cpd26248
seedM:M_cpd28823
secondary/obsolete/fantasy identifier