1.0 2010-04-08 22:11:25 UTC 2019-11-26 03:10:36 UTC FDB014687 Enokipodin B Metabolite of Flammulina velutipes (velvet shank). Enokipodin B is found in mushrooms. Enokipodin B C15H18O3 246.3016 246.125594442 2-methyl-5-(1,2,2-trimethyl-4-oxocyclopentyl)cyclohexa-2,5-diene-1,4-dione 2-methyl-5-(1,2,2-trimethyl-4-oxocyclopentyl)cyclohexa-2,5-diene-1,4-dione 306951-08-6 CC1=CC(=O)C(=CC1=O)C1(C)CC(=O)CC1(C)C InChI=1S/C15H18O3/c1-9-5-13(18)11(6-12(9)17)15(4)8-10(16)7-14(15,2)3/h5-6H,7-8H2,1-4H3 ZDVNWZXSNSTHPK-UHFFFAOYSA-N belongs to the class of organic compounds known as sesquiterpenoids. These are terpenes with three consecutive isoprene units. Sesquiterpenoids Organic compounds Lipids and lipid-like molecules Prenol lipids Sesquiterpenoids Aliphatic homomonocyclic compounds Hydrocarbon derivatives Organic oxides P-benzoquinones Aliphatic homomonocyclic compound Carbonyl group Cuparane sesquiterpenoid Cyclic ketone Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound P-benzoquinone Quinone Sesquiterpenoid logp 2.62 ALOGPS logs -3.26 ALOGPS solubility 1.34e-01 g/l ALOGPS logp 2.68 ChemAxon pka_strongest_acidic 19.71 ChemAxon pka_strongest_basic -7.3 ChemAxon iupac 2-methyl-5-(1,2,2-trimethyl-4-oxocyclopentyl)cyclohexa-2,5-diene-1,4-dione ChemAxon average_mass 246.3016 ChemAxon mono_mass 246.125594442 ChemAxon smiles CC1=CC(=O)C(=CC1=O)C1(C)CC(=O)CC1(C)C ChemAxon formula C15H18O3 ChemAxon inchi InChI=1S/C15H18O3/c1-9-5-13(18)11(6-12(9)17)15(4)8-10(16)7-14(15,2)3/h5-6H,7-8H2,1-4H3 ChemAxon inchikey ZDVNWZXSNSTHPK-UHFFFAOYSA-N ChemAxon polar_surface_area 51.21 ChemAxon refractivity 70.43 ChemAxon polarizability 26.24 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 3 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 20937 Specdb::CMs 166114 Specdb::MsMs 46596 Specdb::MsMs 46597 Specdb::MsMs 46598 Specdb::MsMs 153648 Specdb::MsMs 153649 Specdb::MsMs 153650 Specdb::MsMs 2685990 Specdb::MsMs 2685991 Specdb::MsMs 2685992 Specdb::MsMs 2992136 Specdb::MsMs 2992137 Specdb::MsMs 2992138 HMDB35902 #<Reference:0x000055ce32dd4bd0> Common mushroom Type 1 specific Agaricus bisporus 5341 Mushrooms Unknown generic Oyster mushroom Type 1 specific Pleurotus ostreatus 5322