1.02010-04-08 22:13:13 UTC2019-11-26 03:15:00 UTCFDB0176574-(3,4-Dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-oneIsolated 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-oneC19H12O4304.2962304.0735588724-(3,4-dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-one4-(3,4-dihydroxyphenyl)-2-hydroxyphenalen-1-oneOC1=CC2=C(C=CC3=C2C(=CC=C3)C1=O)C1=CC(O)=C(O)C=C1InChI=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/h1-9,20-22HZNAZPYKRTNDUEJ-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.PhenylnaphthalenesOrganic compoundsBenzenoidsNaphthalenesPhenylnaphthalenesAromatic homopolycyclic compounds1-hydroxy-2-unsubstituted benzenoids1-hydroxy-4-unsubstituted benzenoidsAryl ketonesBenzene and substituted derivativesCatecholsEnolsHydrocarbon derivativesOrganic oxidesPhenalenones1-hydroxy-2-unsubstituted benzenoid1-hydroxy-4-unsubstituted benzenoidAromatic homopolycyclic compoundAryl ketoneCatecholEnolHydrocarbon derivativeKetoneMonocyclic benzene moietyOrganic oxideOrganic oxygen compoundOrganooxygen compoundPhenalenPhenalen-1-onePhenolPhenylnaphthalenelogp3.16logs-4.56solubility8.47e-03 g/llogp3.43pka_strongest_acidic8.77pka_strongest_basic-3.6iupac4-(3,4-dihydroxyphenyl)-2-hydroxy-1H-phenalen-1-oneaverage_mass304.2962mono_mass304.073558872smilesOC1=CC2=C(C=CC3=C2C(=CC=C3)C1=O)C1=CC(O)=C(O)C=C1formulaC19H12O4inchiInChI=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/h1-9,20-22HinchikeyZNAZPYKRTNDUEJ-UHFFFAOYSA-Npolar_surface_area77.76refractivity88.33polarizability31.35rotatable_bond_count1acceptor_count4donor_count3physiological_charge0formal_charge0Specdb::CMs17353Specdb::CMs45757Specdb::CMs151568Specdb::MsMs59826Specdb::MsMs59827Specdb::MsMs59828Specdb::MsMs116043Specdb::MsMs116044Specdb::MsMs116045Specdb::MsMs2331294Specdb::MsMs2331295Specdb::MsMs2331296Specdb::MsMs2631746Specdb::MsMs2631747Specdb::MsMs2631748HMDB38322#<Reference:0x0000555675b677b0>FruitsUnknowngeneric