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Aspidinol

PropertiesImage
MNX_IDMNXM42836 Image of MNXM42836
referencechebi:2884
formulaC12H16O4
global charge0
mol weight224.256
InChIKeyGJRJTYFSORWKBE-UHFFFAOYSA-N
InChIInChI=1S/C12H16O4/c1-4-5-8(13)11-9(14)6-10(16-3)7(2)12(11)15/h6,14-15H,4-5H2,1-3H3
SMILESCCCC(=O)C1=C(O)C=C(OC)C(C)=C1O
MNX internals
InChI (mnx)InChI=1/C12H16O4/c1-4-5-8(13)11-9(14)6-10(16-3)7(2)12(11)15/h6,14-15H,4-5H2,1-3H3 Image of MNXM42836
SMILES (mnx)[CH3:1][CH2:4][CH2:5][C:8]([C:11]1=[C:12]([OH:15])[C:7]([CH3:2])=[C:10]([O:16][CH3:3])[CH:6]=[C:9]1[OH:14])=[O:13]
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

seed.compound:cpd07559
seedM:cpd07559
CHEBI:2884
chebi:2884
kegg.compound:C10673
keggC:C10673
GJRJTYFSORWKBE-UHFFFAOYSA-N 		Aspidinol

keggC:M_C10673
seedM:M_cpd07559 		secondary/obsolete/fantasy identifier