1.0 2010-04-08 22:14:01 UTC 2019-11-26 03:16:53 UTC FDB018914 Dihydroprudomenin Isolated from wood of Prunus mume (Japanese apricot). Dihydroprudomenin is found in herbs and spices and fruits. Dihydroprudomenin C23H26O12 494.4453 494.142426296 3,5-dihydroxy-8-methoxy-2-(4-methoxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one 3,5-dihydroxy-8-methoxy-2-(4-methoxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3-dihydro-1-benzopyran-4-one 24512-61-6 COC1=CC=C(C=C1)C1OC2=C(C(O)=CC(OC3OC(CO)C(O)C(O)C3O)=C2OC)C(=O)C1O InChI=1S/C23H26O12/c1-31-10-5-3-9(4-6-10)20-18(29)16(27)14-11(25)7-12(21(32-2)22(14)35-20)33-23-19(30)17(28)15(26)13(8-24)34-23/h3-7,13,15,17-20,23-26,28-30H,8H2,1-2H3 MUNCRDHDUBYFAO-UHFFFAOYSA-N belongs to the class of organic compounds known as flavonoid-7-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Flavonoid-7-O-glycosides Organic compounds Phenylpropanoids and polyketides Flavonoids Flavonoid glycosides Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids 3-hydroxyflavonoids 4'-O-methylated flavonoids 5-hydroxyflavonoids 8-O-methylated flavonoids Acetals Alkyl aryl ethers Anisoles Aryl alkyl ketones Chromones Flavanonols Hexoses Hydrocarbon derivatives Methoxybenzenes O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenolic glycosides Phenoxy compounds Polyols Primary alcohols Secondary alcohols Vinylogous acids 1-benzopyran 1-hydroxy-2-unsubstituted benzenoid 3-hydroxyflavonoid 4p-methoxyflavonoid-skeleton 5-hydroxyflavonoid 8-methoxyflavonoid-skeleton Acetal Alcohol Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzopyran Chromane Chromone Ether Flavan Flavanone Flavanonol Flavonoid-7-o-glycoside Glycosyl compound Hexose monosaccharide Hydrocarbon derivative Hydroxyflavonoid Ketone Methoxybenzene Monocyclic benzene moiety Monosaccharide O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol ether Phenolic glycoside Phenoxy compound Polyol Primary alcohol Secondary alcohol Vinylogous acid logp -0.04 ALOGPS logs -2.37 ALOGPS solubility 2.11e+00 g/l ALOGPS logp -0.16 ChemAxon pka_strongest_acidic 10.21 ChemAxon pka_strongest_basic -3 ChemAxon iupac 3,5-dihydroxy-8-methoxy-2-(4-methoxyphenyl)-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-1-benzopyran-4-one ChemAxon average_mass 494.4453 ChemAxon mono_mass 494.142426296 ChemAxon smiles COC1=CC=C(C=C1)C1OC2=C(C(O)=CC(OC3OC(CO)C(O)C(O)C3O)=C2OC)C(=O)C1O ChemAxon formula C23H26O12 ChemAxon inchi InChI=1S/C23H26O12/c1-31-10-5-3-9(4-6-10)20-18(29)16(27)14-11(25)7-12(21(32-2)22(14)35-20)33-23-19(30)17(28)15(26)13(8-24)34-23/h3-7,13,15,17-20,23-26,28-30H,8H2,1-2H3 ChemAxon inchikey MUNCRDHDUBYFAO-UHFFFAOYSA-N ChemAxon polar_surface_area 184.6 ChemAxon refractivity 115.72 ChemAxon polarizability 48.56 ChemAxon rotatable_bond_count 6 ChemAxon acceptor_count 12 ChemAxon donor_count 6 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 9562 Specdb::CMs 46375 Specdb::CMs 131040 Specdb::CMs 138774 Specdb::NmrOneD 32462 Specdb::NmrOneD 32463 Specdb::NmrOneD 32464 Specdb::NmrOneD 32465 Specdb::NmrOneD 32466 Specdb::NmrOneD 32467 Specdb::NmrOneD 32468 Specdb::NmrOneD 32469 Specdb::NmrOneD 32470 Specdb::NmrOneD 32471 Specdb::NmrOneD 32472 Specdb::NmrOneD 32473 Specdb::NmrOneD 32474 Specdb::NmrOneD 32475 Specdb::NmrOneD 32476 Specdb::NmrOneD 32477 Specdb::NmrOneD 32478 Specdb::NmrOneD 32479 Specdb::NmrOneD 32480 Specdb::NmrOneD 32481 Specdb::MsMs 10613 Specdb::MsMs 10614 Specdb::MsMs 10615 Specdb::MsMs 17285 Specdb::MsMs 17286 Specdb::MsMs 17287 Specdb::MsMs 2473241 Specdb::MsMs 2473242 Specdb::MsMs 2473243 Specdb::MsMs 2489190 Specdb::MsMs 2489191 Specdb::MsMs 2489192 HMDB39357 #<Reference:0x00007f08cd54e688> Fruits Unknown generic Herbs and Spices Unknown generic