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6-isobutyl-4-hydroxy-2-pyrone

PropertiesImage
MNX_IDMNXM14982 Image of MNXM14982
referencemetacycM:CPD-7146
formulaC9H11O3
global charge-1
mol weight167.184
InChIKeyDFYHDDCNKMPXMX-UHFFFAOYSA-M
InChIInChI=1S/C9H12O3/c1-6(2)3-8-4-7(10)5-9(11)12-8/h4-6,10H,3H2,1-2H3/p-1
SMILESCC(C)CC1=CC([O-])=CC(=O)O1
MNX internals
InChI (mnx)InChI=1/C9H12O3/c1-6(2)3-8-4-7(10)5-9(11)12-8/h4-6,10H,3H2,1-2H3 Image of MNXM14982
SMILES (mnx)[CH3:1][CH:6]([CH3:2])[CH2:3][C:8]1=[CH:4][C:7]([OH:10])=[CH:5][C:9](=[O:11])[O:12]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-7146
metacycM:CPD-7146
seed.compound:cpd24733
seedM:cpd24733
DFYHDDCNKMPXMX-UHFFFAOYSA-M
DFYHDDCNKMPXMX-UHFFFAOYSA-N
6-isobutyl-4-hydroxy-2-pyrone
hmdb:HMDB0304229
DFYHDDCNKMPXMX-UHFFFAOYSA-M
6-isobutyl-4-hydroxy-2-pyrone
2-(2-methylpropyl)-6-oxopyran-4-olate
6-(2-Methylpropyl)-2-oxo-2H-pyran-4-olic acid
6-(2-methylpropyl)-2-oxo-2H-pyran-4-olate

seedM:M_cpd24733
secondary/obsolete/fantasy identifier