Search MNXref
 Feedback

3-methylbutanoate

PropertiesImage
MNX_IDMNXM1137662 Image of MNXM1137662
referencechebi:48942
formulaC5H9O2
global charge-1
mol weight101.125
InChIKeyGWYFCOCPABKNJV-UHFFFAOYSA-M
InChIInChI=1S/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7)/p-1
SMILESCC(C)CC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C5H10O2/c1-4(2)3-5(6)7/h4H,3H2,1-2H3,(H,6,7) Image of MNXM1137662
SMILES (mnx)[CH3:1][CH:4]([CH3:2])[CH2:3][C:5](=[O:6])[OH:7]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)16
in models (compartimentalized) 5
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:48942
chebi:48942
GWYFCOCPABKNJV-UHFFFAOYSA-M
3-methylbutanoate
3-methyl-n-butyrate
3-methylbutyrate
beta-methylbutyrate
delphinate
isopentanoate
isopropylacetate
isovalerate
isovalerianate

kegg.compound:C08262
keggC:C08262
GWYFCOCPABKNJV-UHFFFAOYSA-N
3-Methylbutanoic acid
Isovalerate
Isovaleric acid

metacyc.compound:ISOVALERATE
metacycM:ISOVALERATE
GWYFCOCPABKNJV-UHFFFAOYSA-M
3-methylbutanoate
3-methylbutyrate
isovalerate

bigg.metabolite:ival
biggM:ival
GWYFCOCPABKNJV-UHFFFAOYSA-N
Isovalerate

vmhM:isoval
vmhmetabolite:isoval
GWYFCOCPABKNJV-UHFFFAOYSA-M
Isovalerate, 3-Methylbutanoate
3-methylbutanoic acid
hmdb:HMDB0000718
GWYFCOCPABKNJV-UHFFFAOYSA-N
Isovaleric acid
3-Methyl butyric acid
3-Methyl-1-butanoic acid
3-Methyl-N-butyrate
3-Methyl-N-butyric acid
3-Methylbutanoate
3-Methylbutanoic acid
3-Methylbuttersaeure
3-Methylbutyrate
3-Methylbutyric acid
3-Methylbutyric acid: isopropyl-acetate
3-Methylbutyric acid: isopropyl-acetic acid
3-methylbutanoic acid
Delphinate
Delphinic acid
Isobutylformate
Isobutylformic acid
Isopentanoate
Isopentanoic acid
Isopropylacetate
Isopropylacetic acid
Isovalerate
Isovalerianate
Isovalerianic acid
Isovaleriansaeure
b-Methylbutyrate
b-Methylbutyric acid
beta-Methylbutyrate
beta-Methylbutyric acid
beta-methylbutyrate
beta-methylbutyric acid
isovaleric acid

sabiork.compound:10362
sabiorkM:10362
GWYFCOCPABKNJV-UHFFFAOYSA-N
Isovaleric acid
3-Methylbutanoic acid
3-methylbutyric acid
Isopentanoate
beta-methylbutyric acid

seed.compound:cpd05178
seedM:cpd05178
GWYFCOCPABKNJV-UHFFFAOYSA-M
Isovaleric acid
3-Methylbutanoic acid
Isovalerate
isovalerate

lipidmaps:LMFA01020181
lipidmapsM:LMFA01020181
GWYFCOCPABKNJV-UHFFFAOYSA-N
Isovaleric acid
3-methyl-butanoic acid
Delphinic acid
FA 5:0
Isopentanoic acid
Isopropylacetic acid
Isovalerianic acid

envipath:...02eefffa75c9
envipathM:...02eefffa75c9
GWYFCOCPABKNJV-UHFFFAOYSA-M
compound 0061045

SLM:000501374
slm:000501374
GWYFCOCPABKNJV-UHFFFAOYSA-M
isovalerate

reactome:R-ALL-9737163
reactomeM:R-ALL-9737163
CHEBI:28484
chebi:28484
GWYFCOCPABKNJV-UHFFFAOYSA-N
isovaleric acid
3-Methylbutanoic acid
3-Methylbuttersaeure
3-methyl-n-butyric acid
3-methylbutanoic acid
3-methylbutyric acid
ISOVALERIC ACID
Isovalerate
Isovaleriansaeure
Isovaleric acid
beta-methylbutyric acid
delphinic acid
isobutylformic acid
isopentanoic acid
isopropylacetic acid
isovalerianic acid

hmdb:HMDB00718
chebi:24930
chebi:43426
chebi:6069
biggM:M_ival
keggC:M_C08262
seedM:M_cpd05178
vmhM:M_isoval
secondary/obsolete/fantasy identifier