1.0 2010-04-08 22:13:02 UTC 2025-11-19 01:53:33 UTC FDB017345 Ovalicin Found in lettuce seeds (-)-Ovalicin Antibiotic FR 125756 Antibiotic SL 1846 FR 125756 Graphinone OVA SL 1846 C16H24O5 296.3588 296.162373878 4-hydroxy-5-methoxy-4-[2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-one 4-hydroxy-5-methoxy-4-[2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-one 19683-98-8 COC1C(=O)CCC2(CO2)C1(O)C1(C)OC1CC=C(C)C InChI=1S/C16H24O5/c1-10(2)5-6-12-14(3,21-12)16(18)13(19-4)11(17)7-8-15(16)9-20-15/h5,12-13,18H,6-9H2,1-4H3 NESRXFGQJARQNM-UHFFFAOYSA-N belongs to the class of organic compounds known as tertiary alcohols. Tertiary alcohols are compounds in which a hydroxy group, -OH, is attached to a saturated carbon atom R3COH (R not H ). Tertiary alcohols Organic compounds Organic oxygen compounds Organooxygen compounds Alcohols and polyols Aliphatic heteropolycyclic compounds Cyclic alcohols and derivatives Cyclic ketones Dialkyl ethers Epoxides Hydrocarbon derivatives Organic oxides Oxacyclic compounds Aliphatic heteropolycyclic compound Carbonyl group Cyclic alcohol Cyclic ketone Dialkyl ether Ether Hydrocarbon derivative Ketone Organic oxide Organoheterocyclic compound Oxacycle Oxirane Tertiary alcohol logp 1.37 ALOGPS logs -2.25 ALOGPS solubility 1.66e+00 g/l ALOGPS melting_point Mp 93-94° logp 1.26 ChemAxon pka_strongest_acidic 11.5 ChemAxon pka_strongest_basic -3.7 ChemAxon iupac 4-hydroxy-5-methoxy-4-[2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-one ChemAxon average_mass 296.3588 ChemAxon mono_mass 296.162373878 ChemAxon smiles COC1C(=O)CCC2(CO2)C1(O)C1(C)OC1CC=C(C)C ChemAxon formula C16H24O5 ChemAxon inchi InChI=1S/C16H24O5/c1-10(2)5-6-12-14(3,21-12)16(18)13(19-4)11(17)7-8-15(16)9-20-15/h5,12-13,18H,6-9H2,1-4H3 ChemAxon inchikey NESRXFGQJARQNM-UHFFFAOYSA-N ChemAxon polar_surface_area 71.59 ChemAxon refractivity 76.7 ChemAxon polarizability 31.53 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 5 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22998 Specdb::CMs 45691 Specdb::CMs 173444 Specdb::MsMs 52305 Specdb::MsMs 52306 Specdb::MsMs 52307 Specdb::MsMs 167163 Specdb::MsMs 167164 Specdb::MsMs 167165 Specdb::MsMs 2829877 Specdb::MsMs 2829878 Specdb::MsMs 2829879 Specdb::MsMs 2852542 Specdb::MsMs 2852543 Specdb::MsMs 2852544 HMDB38120 #<Reference:0x000055ce32f25520>