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4-oxopentanoate

PropertiesImage
MNX_IDMNXM37702 Image of MNXM37702
referencechebi:39150
formulaC5H7O3
global charge-1
mol weight115.108
InChIKeyJOOXCMJARBKPKM-UHFFFAOYSA-M
InChIInChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)/p-1
SMILESCC(=O)CCC(=O)[O-]
MNX internals
InChI (mnx)InChI=1/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8) Image of MNXM37702
SMILES (mnx)[CH3:1][C:4]([CH2:2][CH2:3][C:5](=[O:7])[OH:8])=[O:6]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)4
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:39150
chebi:39150
JOOXCMJARBKPKM-UHFFFAOYSA-M
4-oxopentanoate
3-acetylpropionate
4-ketovalerate
4-oxovalerate
beta-acetylpropionate
gamma-ketovalerate
laevulinate
levulate
levulinate

seed.compound:cpd32959
seedM:cpd32959
JOOXCMJARBKPKM-UHFFFAOYSA-M
3-acetylpropionic acid
4-ketovaleric acid
4-oxopentanoate
4-oxovaleric acid
gamma-ketovaleric acid
levulinate

metacyc.compound:CPD-16942
metacycM:CPD-16942
JOOXCMJARBKPKM-UHFFFAOYSA-M
4-oxopentanoate
3-acetylpropionic acid
4-ketovaleric acid
4-oxopentanoic acid
4-oxovaleric acid
gamma-ketovaleric acid
levulinate
levulinic acid

CHEBI:45630
chebi:45630
JOOXCMJARBKPKM-UHFFFAOYSA-N
4-oxopentanoic acid
3-acetylpropionic acid
3-ketobutane-1-carboxylic acid
4-ketovaleric acid
4-oxovaleric acid
LAEVULINIC ACID
LEVA
Laevulinsaeure
Levulinsaeure
beta-acetylpropionic acid
gamma-ketovaleric acid
levulic acid
levulinic acid

seed.compound:cpd30659
seedM:cpd30659
4-oxopentanoic acid
levulinic acid
hmdb:HMDB0000720
JOOXCMJARBKPKM-UHFFFAOYSA-N
Levulinic acid
3-Acetylpropionate
3-Acetylpropionic acid
3-Ketobutane-1-carboxylate
3-Ketobutane-1-carboxylic acid
4-Ketovalerate
4-Ketovaleric acid
4-Oxopentanoate
4-Oxopentanoic acid
4-Oxovalerate
4-Oxovaleric acid
4-oxopentanoic acid
Calcium levulate
Calcium levulinate
Diasporal
LAEVULINIC ACID
LAEVULINate
LEVA
Laevulinsaeure
Levulate
Levulic acid
Levulinate
Levulinic acid, ammonium salt
Levulinic acid, calcium salt
Levulinic acid, sodium salt
Levulinsaeure
Magnesium diasporal
Magnesium laevulinate
Magnesium levulinate
b-Acetylpropionate
b-Acetylpropionic acid
beta-Acetylpropionate
beta-Acetylpropionic acid
beta-acetylpropionate
beta-acetylpropionic acid
g-Ketovalerate
g-Ketovaleric acid
gamma-Ketovalerate
gamma-Ketovaleric acid
gamma-ketovalerate
gamma-ketovaleric acid
levulinic acid

lipidmaps:LMFA01060006
lipidmapsM:LMFA01060006
JOOXCMJARBKPKM-UHFFFAOYSA-N
Levulinic acid
4-oxo-pentanoic acid
FA 5:1
Levulic acid
O

sabiork.compound:21161
sabiorkM:21161
JOOXCMJARBKPKM-UHFFFAOYSA-N
Levulinic acid
Levulinate

envipath:...393db5af2c0b
envipathM:...393db5af2c0b
JOOXCMJARBKPKM-UHFFFAOYSA-M
compound 0000571

envipath:...11bc681f3b59
envipathM:...11bc681f3b59
JOOXCMJARBKPKM-UHFFFAOYSA-M
compound 0075161

hmdb:HMDB00720
chebi:39149
chebi:45628
seedM:M_cpd30659
seedM:M_cpd32959
secondary/obsolete/fantasy identifier