1.0 2010-04-08 22:15:14 UTC 2019-11-26 03:19:23 UTC FDB020754 2-(4-Methyl-1,3-pentadienyl)anthraquinone Isolated from the hairy root culture of Sesamum indicum (sesame). 2-(4-Methyl-1,3-pentadienyl)anthraquinone is found in fats and oils. 2-(4-Methyl-1,3-pentadienyl)-9,10-anthracenedione, 9CI 3-(3-((2-Methoxyethoxy)methoxy)-1-octenyl)cyclopentanone C20H16O2 288.3398 288.115029756 2-[(1Z)-4-methylpenta-1,3-dien-1-yl]-9,10-dihydroanthracene-9,10-dione 2-[(1Z)-4-methylpenta-1,3-dien-1-yl]anthracene-9,10-dione 150900-95-1 CC(C)=C\C=C/C1=CC2=C(C=C1)C(=O)C1=CC=CC=C1C2=O InChI=1S/C20H16O2/c1-13(2)6-5-7-14-10-11-17-18(12-14)20(22)16-9-4-3-8-15(16)19(17)21/h3-12H,1-2H3/b7-5- BIHNBOKNHXYFQJ-ALCCZGGFSA-N belongs to the class of organic compounds known as anthraquinones. These are organic compounds containing either anthracene-9,10-quinone, 1,4-anthraquinone, or 1,2-anthraquinone. Anthraquinones Organic compounds Benzenoids Anthracenes Anthraquinones Aromatic homopolycyclic compounds Aryl ketones Hydrocarbon derivatives Organic oxides Styrenes 9,10-anthraquinone Anthraquinone Aromatic homopolycyclic compound Aryl ketone Hydrocarbon derivative Ketone Organic oxide Organic oxygen compound Organooxygen compound Styrene logp 4.46 ALOGPS logs -5.18 ALOGPS solubility 1.90e-03 g/l ALOGPS logp 4.81 ChemAxon pka_strongest_basic -7.3 ChemAxon iupac 2-[(1Z)-4-methylpenta-1,3-dien-1-yl]-9,10-dihydroanthracene-9,10-dione ChemAxon average_mass 288.3398 ChemAxon mono_mass 288.115029756 ChemAxon smiles CC(C)=C\C=C/C1=CC2=C(C=C1)C(=O)C1=CC=CC=C1C2=O ChemAxon formula C20H16O2 ChemAxon inchi InChI=1S/C20H16O2/c1-13(2)6-5-7-14-10-11-17-18(12-14)20(22)16-9-4-3-8-15(16)19(17)21/h3-12H,1-2H3/b7-5- ChemAxon inchikey BIHNBOKNHXYFQJ-ALCCZGGFSA-N ChemAxon polar_surface_area 34.14 ChemAxon refractivity 91.11 ChemAxon polarizability 32.44 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 2 ChemAxon donor_count 0 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 16449 Specdb::CMs 154136 Specdb::MsMs 302371 Specdb::MsMs 302372 Specdb::MsMs 302373 Specdb::MsMs 345082 Specdb::MsMs 345083 Specdb::MsMs 345084 Specdb::MsMs 2741002 Specdb::MsMs 2741003 Specdb::MsMs 2741004 Specdb::MsMs 2938521 Specdb::MsMs 2938522 Specdb::MsMs 2938523 HMDB40915 #<Reference:0x000055ce2d9af9b0> Fats and oils Unknown generic