1.0 2010-04-08 22:11:55 UTC 2019-11-26 03:11:50 UTC FDB015562 Artabsin Constituent of Artemisia absinthium (wormwood). Artabsin is found in alcoholic beverages and herbs and spices. Artabsin Prochamazulenogenin C15H20O3 248.3175 248.141244506 6-hydroxy-3,6,9-trimethyl-2H,3H,3aH,4H,5H,6H,8H,9bH-azuleno[4,5-b]furan-2-one 6-hydroxy-3,6,9-trimethyl-3H,3aH,4H,5H,8H,9bH-azuleno[4,5-b]furan-2-one 24399-20-0 CC1C2CCC(C)(O)C3=CCC(C)=C3C2OC1=O InChI=1S/C15H20O3/c1-8-4-5-11-12(8)13-10(6-7-15(11,3)17)9(2)14(16)18-13/h5,9-10,13,17H,4,6-7H2,1-3H3 BXBCLQRTBGRRDB-UHFFFAOYSA-N belongs to the class of organic compounds known as gamma butyrolactones. Gamma butyrolactones are compounds containing a gamma butyrolactone moiety, which consists of an aliphatic five-member ring with four carbon atoms, one oxygen atom, and bears a ketone group on the carbon adjacent to the oxygen atom. Gamma butyrolactones Organic compounds Organoheterocyclic compounds Lactones Gamma butyrolactones Aliphatic heteropolycyclic compounds Carbonyl compounds Carboxylic acid esters Cyclic alcohols and derivatives Hydrocarbon derivatives Monocarboxylic acids and derivatives Organic oxides Oxacyclic compounds Tertiary alcohols Tetrahydrofurans Alcohol Aliphatic heteropolycyclic compound Carbonyl group Carboxylic acid derivative Carboxylic acid ester Cyclic alcohol Gamma butyrolactone Hydrocarbon derivative Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Oxacycle Tertiary alcohol Tetrahydrofuran logp 3.03 ALOGPS logs -2.56 ALOGPS solubility 6.87e-01 g/l ALOGPS melting_point Mp 133-135° logp 1.61 ChemAxon pka_strongest_acidic 14.36 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac 6-hydroxy-3,6,9-trimethyl-2H,3H,3aH,4H,5H,6H,8H,9bH-azuleno[4,5-b]furan-2-one ChemAxon average_mass 248.3175 ChemAxon mono_mass 248.141244506 ChemAxon smiles CC1C2CCC(C)(O)C3=CCC(C)=C3C2OC1=O ChemAxon formula C15H20O3 ChemAxon inchi InChI=1S/C15H20O3/c1-8-4-5-11-12(8)13-10(6-7-15(11,3)17)9(2)14(16)18-13/h5,9-10,13,17H,4,6-7H2,1-3H3 ChemAxon inchikey BXBCLQRTBGRRDB-UHFFFAOYSA-N ChemAxon polar_surface_area 46.53 ChemAxon refractivity 69.57 ChemAxon polarizability 27.5 ChemAxon rotatable_bond_count 0 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 26048 Specdb::CMs 44948 Specdb::CMs 167402 Specdb::MsMs 10685 Specdb::MsMs 10686 Specdb::MsMs 10687 Specdb::MsMs 17357 Specdb::MsMs 17358 Specdb::MsMs 17359 Specdb::MsMs 2389288 Specdb::MsMs 2389289 Specdb::MsMs 2389290 Specdb::MsMs 2573345 Specdb::MsMs 2573346 Specdb::MsMs 2573347 HMDB36641 #<Reference:0x000055ce321fac10> Alcoholic beverages Unknown generic Herbs and Spices Unknown generic