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6-(4-methyl-2-oxopentyl)-4-hydroxy-2-pyrone

PropertiesImage
MNX_IDMNXM14963 Image of MNXM14963
referencemetacycM:CPD-7147
formulaC11H13O4
global charge-1
mol weight209.221
InChIKeyGACVANPZCDHOHT-UHFFFAOYSA-M
InChIInChI=1S/C11H14O4/c1-7(2)3-8(12)4-10-5-9(13)6-11(14)15-10/h5-7,13H,3-4H2,1-2H3/p-1
SMILESCC(C)CC(=O)CC1=CC([O-])=CC(=O)O1
MNX internals
InChI (mnx)InChI=1/C11H14O4/c1-7(2)3-8(12)4-10-5-9(13)6-11(14)15-10/h5-7,13H,3-4H2,1-2H3 Image of MNXM14963
SMILES (mnx)[CH3:1][CH:7]([CH3:2])[CH2:3][C:8]([CH2:4][C:10]1=[CH:5][C:9]([OH:13])=[CH:6][C:11](=[O:14])[O:15]1)=[O:12]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-7147
metacycM:CPD-7147
seed.compound:cpd24734
seedM:cpd24734
GACVANPZCDHOHT-UHFFFAOYSA-M
GACVANPZCDHOHT-UHFFFAOYSA-N
6-(4-methyl-2-oxopentyl)-4-hydroxy-2-pyrone
hmdb:HMDB0304223
GACVANPZCDHOHT-UHFFFAOYSA-M
6-(4-methyl-2-oxopentyl)-4-hydroxy-2-pyrone
2-(4-methyl-2-oxopentyl)-6-oxopyran-4-olate
6-(4-Methyl-2-oxopentyl)-2-oxo-2H-pyran-4-olic acid
6-(4-methyl-2-oxopentyl)-2-oxo-2H-pyran-4-olate

seedM:M_cpd24734
secondary/obsolete/fantasy identifier