1.0 2010-04-08 22:13:13 UTC 2019-11-26 03:15:00 UTC FDB017657 4-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one Isolated from Musa acuminata (dwarf banana). 4-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one is found in fruits. 4-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one C19H12O4 304.2962 304.073558872 4-(3,4-dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one 4-(3,4-dihydroxyphenyl)-2-hydroxyphenalen-1-one OC1=CC2=C(C=CC3=C2C(=CC=C3)C1=O)C1=CC(O)=C(O)C=C1 InChI=1S/C19H12O4/c20-15-7-5-11(8-16(15)21)12-6-4-10-2-1-3-13-18(10)14(12)9-17(22)19(13)23/h1-9,20-22H ZNAZPYKRTNDUEJ-UHFFFAOYSA-N belongs to the class of organic compounds known as phenylnaphthalenes. Phenylnaphthalenes are compounds containing a phenylnaphthalene skeleton, which consists of a naphthalene bound to a phenyl group. Phenylnaphthalenes Organic compounds Benzenoids Naphthalenes Phenylnaphthalenes Aromatic homopolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Aryl ketones Benzene and substituted derivatives Catechols Enols Hydrocarbon derivatives Organic oxides Phenalenones 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Aromatic homopolycyclic compound Aryl ketone Catechol Enol Hydrocarbon derivative Ketone Monocyclic benzene moiety Organic oxide Organic oxygen compound Organooxygen compound Phenalen Phenalen-1-one Phenol Phenylnaphthalene logp 3.16 ALOGPS logs -4.56 ALOGPS solubility 8.47e-03 g/l ALOGPS logp 3.43 ChemAxon pka_strongest_acidic 8.77 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 4-(3,4-dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one ChemAxon average_mass 304.2962 ChemAxon mono_mass 304.073558872 ChemAxon smiles OC1=CC2=C(C=CC3=C2C(=CC=C3)C1=O)C1=CC(O)=C(O)C=C1 ChemAxon formula C19H12O4 ChemAxon inchi InChI=1S/C19H12O4/c20-15-7-5-11(8-16(15)21)12-6-4-10-2-1-3-13-18(10)14(12)9-17(22)19(13)23/h1-9,20-22H ChemAxon inchikey ZNAZPYKRTNDUEJ-UHFFFAOYSA-N ChemAxon polar_surface_area 77.76 ChemAxon refractivity 88.33 ChemAxon polarizability 31.35 ChemAxon rotatable_bond_count 1 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 17353 Specdb::CMs 45757 Specdb::CMs 151568 Specdb::MsMs 59826 Specdb::MsMs 59827 Specdb::MsMs 59828 Specdb::MsMs 116043 Specdb::MsMs 116044 Specdb::MsMs 116045 Specdb::MsMs 2331294 Specdb::MsMs 2331295 Specdb::MsMs 2331296 Specdb::MsMs 2631746 Specdb::MsMs 2631747 Specdb::MsMs 2631748 HMDB38322 #<Reference:0x000055ce331d3f10> Fruits Unknown generic