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4-Hydroxy-6-methyl-3-(1-oxobutyl)-2H-pyran-2-one

PropertiesImage
MNX_IDMNXM117920 Image of MNXM117920
referencechebi:173972
formulaC10H12O4
global charge0
mol weight196.202
InChIKeyCVTPSMRXSUPVPJ-UHFFFAOYSA-N
InChIInChI=1S/C10H12O4/c1-3-4-7(11)9-8(12)5-6(2)14-10(9)13/h5,12H,3-4H2,1-2H3
SMILESCCCC(=O)C1=C(O)C=C(C)OC1=O
MNX internals
InChI (mnx)InChI=1/C10H12O4/c1-3-4-7(11)9-8(12)5-6(2)14-10(9)13/h5,12H,3-4H2,1-2H3 Image of MNXM117920
SMILES (mnx)[CH3:1][CH2:3][CH2:4][C:7]([C:9]1=[C:8]([OH:12])[CH:5]=[C:6]([CH3:2])[O:14][C:10]1=[O:13])=[O:11]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:173972
chebi:173972
CVTPSMRXSUPVPJ-UHFFFAOYSA-N
4-Hydroxy-6-methyl-3-(1-oxobutyl)-2H-pyran-2-one
3-butanoyl-4-hydroxy-6-methylpyran-2-one
hmdb:HMDB0040637
CVTPSMRXSUPVPJ-UHFFFAOYSA-N
4-Hydroxy-6-methyl-3-(1-oxobutyl)-2H-pyran-2-one
3-butanoyl-4-hydroxy-6-methyl-2H-pyran-2-one
3-butanoyl-4-hydroxy-6-methylpyran-2-one

hmdb:HMDB40637
secondary/obsolete/fantasy identifier