1.0 2010-04-08 22:12:01 UTC 2019-11-26 03:12:06 UTC FDB015720 Diosbulbin C Constituent of Dioscorea bulbifera (air potato). Diosbulbin C is found in root vegetables. Diosbulbin C C19H22O7 362.3738 362.136553058 3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.0¹,⁵.0⁶,¹¹]pentadecane-10-carboxylic acid 3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.0¹,⁵.0⁶,¹¹]pentadecane-10-carboxylic acid 20086-07-1 CC12CC(OC11CC(OC1=O)C1C(CC(O)CC21)C(O)=O)C1=COC=C1 InChI=1S/C19H22O7/c1-18-6-13(9-2-3-24-8-9)26-19(18)7-14(25-17(19)23)15-11(16(21)22)4-10(20)5-12(15)18/h2-3,8,10-15,20H,4-7H2,1H3,(H,21,22) UYALWPKCIMKALF-UHFFFAOYSA-N belongs to the class of organic compounds known as naphthofurans. Naphthofurans are compounds containing a furan ring fused to a naphthalene moiety. Furan is a 5 membered- ring aromatic ring with four carbon and one oxygen atoms. Naphthalene is a polycyclic aromatic hydrocarbon made up of two fused benzene rings. Naphthofurans Organic compounds Organoheterocyclic compounds Naphthofurans Aromatic heteropolycyclic compounds Carbonyl compounds Carboxylic acid esters Carboxylic acids Cyclic alcohols and derivatives Dialkyl ethers Dicarboxylic acids and derivatives Furans Gamma butyrolactones Heteroaromatic compounds Hydrocarbon derivatives Organic oxides Oxacyclic compounds Oxepanes Secondary alcohols Tetrahydrofurans Alcohol Aromatic heteropolycyclic compound Caprolactone Carbonyl group Carboxylic acid Carboxylic acid derivative Carboxylic acid ester Cyclic alcohol Dialkyl ether Dicarboxylic acid or derivatives Ether Furan Gamma butyrolactone Heteroaromatic compound Hydrocarbon derivative Lactone Naphthofuran Organic oxide Organic oxygen compound Organooxygen compound Oxacycle Oxepane Secondary alcohol Tetrahydrofuran logp 1.02 ALOGPS logs -2.80 ALOGPS solubility 5.73e-01 g/l ALOGPS melting_point Mp 247-250° dec. logp 0.94 ChemAxon pka_strongest_acidic 4.33 ChemAxon pka_strongest_basic -2.7 ChemAxon iupac 3-(furan-3-yl)-8-hydroxy-5-methyl-14-oxo-2,13-dioxatetracyclo[10.2.1.0¹,⁵.0⁶,¹¹]pentadecane-10-carboxylic acid ChemAxon average_mass 362.3738 ChemAxon mono_mass 362.136553058 ChemAxon smiles CC12CC(OC11CC(OC1=O)C1C(CC(O)CC21)C(O)=O)C1=COC=C1 ChemAxon formula C19H22O7 ChemAxon inchi InChI=1S/C19H22O7/c1-18-6-13(9-2-3-24-8-9)26-19(18)7-14(25-17(19)23)15-11(16(21)22)4-10(20)5-12(15)18/h2-3,8,10-15,20H,4-7H2,1H3,(H,21,22) ChemAxon inchikey UYALWPKCIMKALF-UHFFFAOYSA-N ChemAxon polar_surface_area 106.2 ChemAxon refractivity 86.55 ChemAxon polarizability 36.33 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 5 ChemAxon donor_count 2 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 23549 Specdb::CMs 45032 Specdb::CMs 168573 Specdb::MsMs 86700 Specdb::MsMs 86701 Specdb::MsMs 86702 Specdb::MsMs 149055 Specdb::MsMs 149056 Specdb::MsMs 149057 Specdb::MsMs 2672927 Specdb::MsMs 2672928 Specdb::MsMs 2672929 Specdb::MsMs 3032750 Specdb::MsMs 3032751 Specdb::MsMs 3032752 HMDB36778 #<Reference:0x000055ce309af070> Root vegetables Unknown generic