1.0 2010-04-08 22:11:27 UTC 2025-11-19 00:49:29 UTC FDB014765 Artonin D Constituent of Artocarpus heterophyllus (jackfruit). Artonin D is found in jackfruit and fruits. C40H36O10 676.7078 676.230847372 (2E)-3-(2,4-dihydroxyphenyl)-1-{3-[5-(2,4-dihydroxyphenyl)-6-(5-hydroxy-2,2-dimethyl-2H-chromene-6-carbonyl)-3-methylcyclohex-2-en-1-yl]-2,4-dihydroxyphenyl}prop-2-en-1-one (2E)-3-(2,4-dihydroxyphenyl)-1-{3-[5-(2,4-dihydroxyphenyl)-6-(5-hydroxy-2,2-dimethylchromene-6-carbonyl)-3-methylcyclohex-2-en-1-yl]-2,4-dihydroxyphenyl}prop-2-en-1-one 128532-95-6 CC1=CC(C(C(C1)C1=C(O)C=C(O)C=C1)C(=O)C1=C(O)C2=C(OC(C)(C)C=C2)C=C1)C1=C(O)C=CC(C(=O)\C=C\C2=C(O)C=C(O)C=C2)=C1O InChI=1S/C40H36O10/c1-20-16-28(24-8-7-23(42)19-33(24)46)35(39(49)27-10-13-34-26(37(27)47)14-15-40(2,3)50-34)29(17-20)36-31(44)12-9-25(38(36)48)30(43)11-5-21-4-6-22(41)18-32(21)45/h4-15,17-19,28-29,35,41-42,44-48H,16H2,1-3H3/b11-5+ JIQSDJNLGMFGDV-VZUCSPMQSA-N belongs to the class of organic compounds known as 2'-hydroxychalcones. These are organic compounds containing chalcone skeleton that carries a hydroxyl group at the 2'-position. 2'-Hydroxychalcones Organic compounds Phenylpropanoids and polyketides Linear 1,3-diarylpropanoids Chalcones and dihydrochalcones Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids 2,2-dimethyl-1-benzopyrans Acryloyl compounds Alkyl aryl ethers Aryl alkyl ketones Benzoyl derivatives Cinnamylphenols Enones Hydrocarbon derivatives Hydroxycinnamic acids and derivatives Organic oxides Oxacyclic compounds Resorcinols Styrenes Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 2'-hydroxychalcone 2,2-dimethyl-1-benzopyran Acryloyl-group Alkyl aryl ether Alpha,beta-unsaturated ketone Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Benzoyl Cinnamylphenol Enone Ether Hydrocarbon derivative Hydroxycinnamic acid or derivatives Ketone Monocyclic benzene moiety Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Phenol Resorcinol Styrene Vinylogous acid logp 5.38 ALOGPS logs -5.55 ALOGPS solubility 1.92e-03 g/l ALOGPS melting_point Mp 140-143° logp 8.36 ChemAxon pka_strongest_acidic 7.51 ChemAxon pka_strongest_basic -4 ChemAxon iupac (2E)-3-(2,4-dihydroxyphenyl)-1-{3-[5-(2,4-dihydroxyphenyl)-6-(5-hydroxy-2,2-dimethyl-2H-chromene-6-carbonyl)-3-methylcyclohex-2-en-1-yl]-2,4-dihydroxyphenyl}prop-2-en-1-one ChemAxon average_mass 676.7078 ChemAxon mono_mass 676.230847372 ChemAxon smiles CC1=CC(C(C(C1)C1=C(O)C=C(O)C=C1)C(=O)C1=C(O)C2=C(OC(C)(C)C=C2)C=C1)C1=C(O)C=CC(C(=O)\C=C\C2=C(O)C=C(O)C=C2)=C1O ChemAxon formula C40H36O10 ChemAxon inchi InChI=1S/C40H36O10/c1-20-16-28(24-8-7-23(42)19-33(24)46)35(39(49)27-10-13-34-26(37(27)47)14-15-40(2,3)50-34)29(17-20)36-31(44)12-9-25(38(36)48)30(43)11-5-21-4-6-22(41)18-32(21)45/h4-15,17-19,28-29,35,41-42,44-48H,16H2,1-3H3/b11-5+ ChemAxon inchikey JIQSDJNLGMFGDV-VZUCSPMQSA-N ChemAxon polar_surface_area 184.98 ChemAxon refractivity 191.43 ChemAxon polarizability 71.49 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 10 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 22689 Specdb::CMs 719765 Specdb::CMs 719766 Specdb::CMs 719767 Specdb::CMs 719768 Specdb::CMs 719769 Specdb::CMs 719770 Specdb::CMs 719771 Specdb::CMs 719772 Specdb::CMs 719773 Specdb::CMs 719774 Specdb::CMs 719775 Specdb::CMs 719776 Specdb::CMs 719777 Specdb::CMs 719778 Specdb::CMs 719779 Specdb::CMs 719780 Specdb::CMs 719781 Specdb::CMs 719782 Specdb::CMs 719783 Specdb::CMs 719784 Specdb::CMs 719785 Specdb::CMs 719786 Specdb::CMs 719787 Specdb::CMs 719788 Specdb::MsMs 94167 Specdb::MsMs 94168 Specdb::MsMs 94169 Specdb::MsMs 158145 Specdb::MsMs 158146 Specdb::MsMs 158147 Specdb::MsMs 2441989 Specdb::MsMs 2441990 Specdb::MsMs 2441991 Specdb::MsMs 2520347 Specdb::MsMs 2520348 Specdb::MsMs 2520349 HMDB35961 #<Reference:0x000055ce3065ad48> Fruits Unknown generic Jackfruit Type 1 specific Artocarpus heterophyllus 3489