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2-methylpropanoate

MNXM2531 is deprecated and here replaced by MNXM1137660
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1137660 Image of MNXM1137660
referencechebi:48944
formulaC4H7O2
global charge-1
mol weight87.098
InChIKeyKQNPFQTWMSNSAP-UHFFFAOYSA-M
InChIInChI=1S/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6)/p-1
SMILESCC(C)C(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C4H8O2/c1-3(2)4(5)6/h3H,1-2H3,(H,5,6) Image of MNXM1137660
SMILES (mnx)[CH3:1][CH:3]([CH3:2])[C:4](=[O:5])[OH:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)24
in models (compartimentalized) 5
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:48944
chebi:48944
KQNPFQTWMSNSAP-UHFFFAOYSA-M 		2-methylpropanoate
2-methylpropanoic acid, ion(1-)
2-methylpropionate
Isobutyrat
i-butyrate
iPrCO2 anion
isobutanoate
isobutyrate
isobutyric acid anion
methylpropanoate

kegg.compound:C02632
keggC:C02632
KQNPFQTWMSNSAP-UHFFFAOYSA-N 		2-Methylpropanoate
2-Methylpropanoic acid
Dimethylacetic acid
Isobutanoate
Isobutyrate
Isobutyric acid

sabiork.compound:2473
sabiorkM:2473
KQNPFQTWMSNSAP-UHFFFAOYSA-M 		Isobutanoate
2-Methylpropanoate
2-Methylpropanoic acid
Dimethylacetic acid
Isobutyrate
Isobutyric acid

envipath:...ff36daf7b7fd
envipathM:...ff36daf7b7fd
KQNPFQTWMSNSAP-UHFFFAOYSA-M 		Isobutyrate

vmhM:isobut
vmhmetabolite:isobut
KQNPFQTWMSNSAP-UHFFFAOYSA-M 		Isobutyrate, 2-Methylpropanoate
2-methylpropanoic acid

seed.compound:cpd01711
seedM:cpd01711
KQNPFQTWMSNSAP-UHFFFAOYSA-M 		Isobutyrate
2-Methylpropanoate
2-Methylpropanoic acid
2-methylpropanoate
2-methylpropanoic acid
2-methylpropionic acid
Dimethylacetic acid
Isobutanoate
Isobutyric acid
dimethylacetic acid
isobutanoate
isobutyrate
isobutyric acid

bigg.metabolite:isobuta
biggM:isobuta
KQNPFQTWMSNSAP-UHFFFAOYSA-N 		Isobutyric acid
hmdb:HMDB0001873
KQNPFQTWMSNSAP-UHFFFAOYSA-N 		Isobutyric acid
2,2-Dimethylacetate
2,2-Dimethylacetic acid
2-METHYL-propionIC ACID
2-METHYL-propionate
2-Methpropanoic acid
2-Methylpropanoate
2-Methylpropanoic acid
2-Methylpropionate
2-Methylpropionic acid
2-Methylpropionsaeure
2-methylpropanoic acid
Ammonium isobutyrate
Dimethylacetate
Dimethylacetic acid
I-butyrate
I-butyric acid
Iso-C3H7COOH
Iso-butyrate
Iso-butyric acid
Isobutanoate
Isobutanoic acid
Isobuttersaeure
Isobutyrate
Isobutyric acid, ammonium salt
Isobutyric acid, calcium salt
Isobutyric acid, hemiammoniate
Isobutyric acid, nickel salt
Isobutyric acid, potassium salt
Isobutyric acid, sodium salt
Isobutyric acid, sodium salt, 11C-labeled
Isobutyric acid, sodium salt, 14C-labeled
Isopropylformate
Isopropylformic acid
Sodium isobutyrate
a-Isobutyrate
a-Isobutyric acid
a-Methylpropanoate
a-Methylpropanoic acid
a-Methylpropionate
a-Methylpropionic acid
alpha-Isobutyrate
alpha-Isobutyric acid
alpha-Methylpropanoate
alpha-Methylpropanoic acid
alpha-Methylpropionate
alpha-Methylpropionic acid
alpha-isobutyrate
alpha-isobutyric acid
alpha-methylpropanoate
alpha-methylpropanoic acid
alpha-methylpropionate
alpha-methylpropionic acid
isobutyric acid

lipidmaps:LMFA01020071
lipidmapsM:LMFA01020071
KQNPFQTWMSNSAP-UHFFFAOYSA-N 		Isobutyric acid
2-methyl-propanoic acid
FA 4:0

envipath:...88261a98ca92
envipathM:...88261a98ca92
KQNPFQTWMSNSAP-UHFFFAOYSA-M 		compound 0038802

SLM:000389507
slm:000389507
KQNPFQTWMSNSAP-UHFFFAOYSA-M 		isobutanoate

metacyc.compound:ISOBUTYRATE
metacycM:ISOBUTYRATE
KQNPFQTWMSNSAP-UHFFFAOYSA-M 		isobutanoate
2-methylpropanoate
2-methylpropanoic acid
2-methylpropionic acid
dimethylacetic acid
isobutyrate
isobutyric acid

CHEBI:16135
chebi:16135
KQNPFQTWMSNSAP-UHFFFAOYSA-N 		isobutyric acid
2,2-dimethylacetic acid
2-METHYL-PROPIONIC ACID
2-Methylpropanoate
2-Methylpropanoic acid
2-Methylpropionsaeure
2-methylpropanoic acid
Dimethylacetic acid
ISOBUTYRIC ACID
Isobutanoate
Isobuttersaeure
Isobutyrate
Isobutyric acid
alpha-isobutyric acid
alpha-methylpropanoic acid
alpha-methylpropionic acid
iso-C3H7COOH
iso-butyric acid
isobutanoic acid
isopropylformic acid

hmdb:HMDB0003151
hmdb:HMDB01873
hmdb:HMDB03151
chebi:11627
chebi:1212
chebi:19710
chebi:25334
chebi:25337
chebi:40653
chebi:43397
biggM:M_isobuta
keggC:M_C02632
seedM:M_cpd01711
vmhM:M_isobut 		secondary/obsolete/fantasy identifier