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beta-thujaplicin

Properties

Image

Occurences in reactions

MNX_ID

MNXM103176

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₀H₁₂O₂

charge

mass

164.08373

reference

InChIKey

FUWUEFKEXZQKKA-UHFFFAOYSA-N

InChI

InChI=1S/C10H12O2/c1-7(2)8-4-3-5-9(11)10(12)6-8/h3-7H,1-2H3,(H,11,12)

SMILES

CC(C)c1cccc(=O)c(O)c1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:10447 chebi:10447	beta-thujaplicin 2-hydroxy-4-(propan-2-yl)cyclohepta-2,4,6-trien-1-one 2-hydroxy-4-isopropyl-cyclohepta2,4,6-trien-1-one 4-Isopropyltropolone Hinokitiol beta-Thujaplicin
kegg.drug:D04876 keggD:D04876	Hinokitiol
seed.compound:cpd06794 seedM:cpd06794	Hinokitiol 4-Isopropyltropolone beta-Thujaplicin
hmdb:HMDB0035213	beta-Thujaplicin 2-Hydroxy-4(6)-(1-methylethyl)-2,4,6-cycloheptatrien-1-one, 9ci 2-Hydroxy-4-(1-methylethyl)-2,4,6-cycloheptatrien-1-one 2-Hydroxy-4-isopropyl- 2,4,6-cycloheptatriene-1-one 2-Hydroxy-4-isopropyl-2,4, 6-cycloheptatrien-1-one 2-Hydroxy-4-isopropyl-2,4,6-cyclohepta-2,4,6-trien-1-one 2-Hydroxy-4-isopropyl-2,4,6-cycloheptatrien-1-one 2-Hydroxy-4-isopropyl-cyclohepta2,4,6-trien-1-one 2-Hydroxy-4-isopropylcyclohepta-2,4,6-trien-1-one 2-hydroxy-6-(propan-2-yl)cyclohepta-2,4,6-trien-1-one 4(6)-Isopropyltropolone 4-Isopropyl-tropolone 4-Isopropyltropolone Hinokitiol Hinokitiol 4-isopropyltropolone Hinokitol Isopropyltropolone Thujaplicin, beta alpha-Thujaplicin b-Thujaplicin beta -Isopropyltropolon beta -Thujaplicin beta -Thujaplicine beta-Isopropyltropolon beta-Isopropyltropolone beta-Thujaplicin, sodium salt beta-Thujaplicine beta-thujaplicin hinokitiol
kegg.compound:C09904 keggC:C09904	beta-Thujaplicin 4-Isopropyltropolone Hinokitiol
hmdb:HMDB35213 chebi:66015 keggC:M_C09904 keggD:M_D04876 seedM:M_cpd06794	secondary/obsolete/fantasy identifier