1.0 2010-04-08 22:13:22 UTC 2019-11-26 03:15:23 UTC FDB017886 Rheidin B Isolated from rhubarb roots. Rheidin B is found in green vegetables. Reidin B Rheidin B C30H20O8 508.475 508.115817616 9-(4,5-dihydroxy-2-methyl-10-oxo-9,10-dihydroanthracen-9-yl)-4,5-dihydroxy-10-oxo-9,10-dihydroanthracene-2-carboxylic acid 9-(4,5-dihydroxy-2-methyl-10-oxo-9H-anthracen-9-yl)-4,5-dihydroxy-10-oxo-9H-anthracene-2-carboxylic acid CC1=CC2=C(C(O)=C1)C(=O)C1=C(C=CC=C1O)C2C1C2=C(C(O)=CC=C2)C(=O)C2=C1C=C(C=C2O)C(O)=O InChI=1S/C30H20O8/c1-12-8-16-22(14-4-2-6-18(31)24(14)28(35)26(16)20(33)9-12)23-15-5-3-7-19(32)25(15)29(36)27-17(23)10-13(30(37)38)11-21(27)34/h2-11,22-23,31-34H,1H3,(H,37,38) BYPYDHLERFKKKV-UHFFFAOYSA-N belongs to the class of organic compounds known as anthracenecarboxylic acids. These are organic compounds containing a carboxylic acid group attached to an anthracene ring system. Anthracenecarboxylic acids Organic compounds Benzenoids Anthracenes Anthracenecarboxylic acids and derivatives Aromatic homopolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Aryl ketones Carboxylic acids Hydrocarbon derivatives Hydroxybenzoic acid derivatives Monocarboxylic acids and derivatives Naphthalenecarboxylic acids Organic oxides Vinylogous acids 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid 2-naphthalenecarboxylic acid 2-naphthalenecarboxylic acid or derivatives Anthracene carboxylic acid Aromatic homopolycyclic compound Aryl ketone Carboxylic acid Carboxylic acid derivative Hydrocarbon derivative Hydroxybenzoic acid Ketone Monocarboxylic acid or derivatives Organic oxide Organic oxygen compound Organooxygen compound Vinylogous acid logp 4.23 ALOGPS logs -4.86 ALOGPS solubility 6.99e-03 g/l ALOGPS logp 7.88 ChemAxon pka_strongest_acidic 3.53 ChemAxon pka_strongest_basic -4.4 ChemAxon iupac 9-(4,5-dihydroxy-2-methyl-10-oxo-9,10-dihydroanthracen-9-yl)-4,5-dihydroxy-10-oxo-9,10-dihydroanthracene-2-carboxylic acid ChemAxon average_mass 508.475 ChemAxon mono_mass 508.115817616 ChemAxon smiles CC1=CC2=C(C(O)=C1)C(=O)C1=C(C=CC=C1O)C2C1C2=C(C(O)=CC=C2)C(=O)C2=C1C=C(C=C2O)C(O)=O ChemAxon formula C30H20O8 ChemAxon inchi InChI=1S/C30H20O8/c1-12-8-16-22(14-4-2-6-18(31)24(14)28(35)26(16)20(33)9-12)23-15-5-3-7-19(32)25(15)29(36)27-17(23)10-13(30(37)38)11-21(27)34/h2-11,22-23,31-34H,1H3,(H,37,38) ChemAxon inchikey BYPYDHLERFKKKV-UHFFFAOYSA-N ChemAxon polar_surface_area 152.36 ChemAxon refractivity 138.94 ChemAxon polarizability 49.52 ChemAxon rotatable_bond_count 2 ChemAxon acceptor_count 8 ChemAxon donor_count 5 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 25774 Specdb::CMs 45875 Specdb::MsMs 47391 Specdb::MsMs 47392 Specdb::MsMs 47393 Specdb::MsMs 143451 Specdb::MsMs 143452 Specdb::MsMs 143453 Specdb::MsMs 2438896 Specdb::MsMs 2438897 Specdb::MsMs 2438898 Specdb::MsMs 2523789 Specdb::MsMs 2523790 Specdb::MsMs 2523791 HMDB38509 #<Reference:0x000055ce33598628> Green vegetables Unknown generic