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Bisacurone B

PropertiesImage
MNX_IDMNXM119818 Image of MNXM119818
referencechebi:167989
formulaC15H24O3
global charge0
mol weight252.354
InChIKeyQJOWFYQIUZMPRY-UHFFFAOYSA-N
InChIInChI=1S/C15H24O3/c1-10(2)7-13(16)8-11(3)12-5-6-15(4,18)14(17)9-12/h5-7,11-12,14,17-18H,8-9H2,1-4H3
SMILESCC(C)=CC(=O)CC(C)C1C=CC(C)(O)C(O)C1
MNX internals
InChI (mnx)InChI=1/C15H24O3/c1-10(2)7-13(16)8-11(3)12-5-6-15(4,18)14(17)9-12/h5-7,11-12,14,17-18H,8-9H2,1-4H3/t11?,12?,14?,15? Image of MNXM119818
SMILES (mnx)[CH3:1][C:10]([CH3:2])=[CH:7][C:13]([CH2:8][CH:11]([CH3:3])[CH:12]1[CH:5]=[CH:6][C:15]([CH3:4])([OH:18])[CH:14]([OH:17])[CH2:9]1)=[O:16]
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

hmdb:HMDB0038502
CHEBI:167989
chebi:167989
QJOWFYQIUZMPRY-UHFFFAOYSA-N
Bisacurone B
6-(4,5-dihydroxy-4-methylcyclohex-2-en-1-yl)-2-methylhept-2-en-4-one

hmdb:HMDB38502
secondary/obsolete/fantasy identifier