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2-methylbutanedioic acid

PropertiesImage
MNX_IDMNXM1368689 Image of MNXM1368689
referencechebi:91315
formulaC5H8O4
global charge0
mol weight132.115
InChIKeyWXUAQHNMJWJLTG-UHFFFAOYSA-N
InChIInChI=1S/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)
SMILESCC(CC(=O)O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9)/t3? Image of MNXM1368689
SMILES (mnx)[CH3:1][CH:3]([CH2:2][C:4](=[O:6])[OH:7])[C:5](=[O:8])[OH:9]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)7
in models (compartimentalized) 3
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:91315
chebi:91315
WXUAQHNMJWJLTG-UHFFFAOYSA-N 		2-methylbutanedioic acid

bigg.metabolite:methsucc
biggM:methsucc
WXUAQHNMJWJLTG-UHFFFAOYSA-L 		Methyl-Succinate

vmhM:methsucc
vmhmetabolite:methsucc
WXUAQHNMJWJLTG-UHFFFAOYSA-L 		Methyl-Succinate
(2S)-2-methylbutanedioic acid

sabiork.compound:25084
sabiorkM:25084
WXUAQHNMJWJLTG-UHFFFAOYSA-N 		Methylsuccinate

lipidmaps:LMFA01170119
lipidmapsM:LMFA01170119
WXUAQHNMJWJLTG-UHFFFAOYSA-N 		Methylsuccinic acid
2-methyl-butanedioic acid
FA 5:1
O2

envipath:...159acaa38175
envipathM:...159acaa38175
WXUAQHNMJWJLTG-UHFFFAOYSA-L 		compound 0236763

seed.compound:cpd24381
seedM:cpd24381
WXUAQHNMJWJLTG-UHFFFAOYSA-L 		methylsuccinate

metacyc.compound:CPD-2461
metacycM:CPD-2461
WXUAQHNMJWJLTG-UHFFFAOYSA-L 		methylsuccinate
2-methylbutanedioate
methylsuccinic acid

biggM:M_methsucc
seedM:M_cpd24381
vmhM:M_methsucc 		secondary/obsolete/fantasy identifier