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3-hydroxy-3-methyl-2-oxobutanoate

PropertiesImage
MNX_IDMNXM1638 Image of MNXM1638
referencechebi:11812
formulaC5H7O4
global charge-1
mol weight131.107
InChIKeyDNOPJXBPONYBLB-UHFFFAOYSA-M
InChIInChI=1S/C5H8O4/c1-5(2,9)3(6)4(7)8/h9H,1-2H3,(H,7,8)/p-1
SMILESCC(C)(O)C(=O)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C5H8O4/c1-5(2,9)3(6)4(7)8/h9H,1-2H3,(H,7,8) Image of MNXM1638
SMILES (mnx)[CH3:1][C:5]([CH3:2])([C:3]([C:4]([OH:7])=[O:8])=[O:6])[OH:9]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 2
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:11812
chebi:11812
DNOPJXBPONYBLB-UHFFFAOYSA-M
3-hydroxy-3-methyl-2-oxobutanoate
2-Oxo-3-hydroxyisovalerate
3-Hydroxy-3-methyl-2-oxobutanoate

vmhM:33hmeoxobut
vmhmetabolite:33hmeoxobut
DNOPJXBPONYBLB-UHFFFAOYSA-M
2-Oxo-3-hydroxyisovalerate

seed.compound:cpd02569
seedM:cpd02569
DNOPJXBPONYBLB-UHFFFAOYSA-M
2-Oxo-3-hydroxyisovalerate
2-oxo-3-hydroxyisovalerate
3-Hydroxy-3-methyl-2-oxobutanoate
3-Hydroxy-3-methyl-2-oxobutanoic acid
3-hydroxy-3-methyl-2-oxobutanoate
33hmeoxobut

sabiork.compound:7135
sabiorkM:7135
DNOPJXBPONYBLB-UHFFFAOYSA-M
3-Hydroxy-3-methyl-2-oxobutanoate
2-Oxo-3-hydroxyisovalerate
3-Hydroxy-3-methyl-2-ketobutyrate

bigg.metabolite:3hmoa
biggM:3hmoa
3-Hydroxy-3-methyl-2-oxobutanoic acid

kegg.compound:C04181
keggC:C04181
DNOPJXBPONYBLB-UHFFFAOYSA-N
3-Hydroxy-3-methyl-2-oxobutanoic acid
2-Oxo-3-hydroxyisovalerate
3-Hydroxy-3-methyl-2-oxobutanoate

lipidmaps:LMFA01020277
lipidmapsM:LMFA01020277
DNOPJXBPONYBLB-UHFFFAOYSA-N
3-hydroxy-3-methyl-2-oxo-butanoic acid
3-hydroxy-3-methyl-2-oxo-butanoic acid
FA 5:1
O2

metacyc.compound:CPD-231
metacycM:CPD-231
DNOPJXBPONYBLB-UHFFFAOYSA-M
3-hydroxy-3-methyl-2-oxobutanoate
2-oxo-3-hydroxyisovalerate

CHEBI:17667
chebi:17667
DNOPJXBPONYBLB-UHFFFAOYSA-N
3-hydroxy-3-methyl-2-oxobutanoic acid
2-oxo-3-hydroxyisovaleric acid
3-Hydroxy-3-methyl-2-oxobutanoate
3-Hydroxy-3-methyl-2-oxobutanoic acid

envipath:...bd3ffebb023c
envipathM:...bd3ffebb023c
DNOPJXBPONYBLB-UHFFFAOYSA-M
compound 0001018

envipath:...ac55f96b9580
envipathM:...ac55f96b9580
DNOPJXBPONYBLB-UHFFFAOYSA-M
compound 0038801

chebi:1522
biggM:M_3hmoa
keggC:M_C04181
seedM:M_cpd02569
vmhM:M_33hmeoxobut
secondary/obsolete/fantasy identifier