1.0 2010-04-08 22:14:27 UTC 2025-11-19 02:21:06 UTC FDB019592 (S)-Multifidol 2-[apiosyl-(1->6)-glucoside] Constituent of the leaves and branches of Phyllanthus emblica (emblic). (S)-Multifidol 2-[apiosyl-(1->6)-glucoside] is found in fruits. (S)-(2-Methylbutyryl)phloroglucinol 2-O-[b-D-apiofuranosyl-(1->6)-b-D-glucopyranoside] (S)-2-Methyl-1-(2,4,6-trihydroxyphenyl)-1-butanone 2-O-[b-D-apiofuranosyl-(1->6)-b-D-glucopyranoside] (S)-Multifidol 2-[apiosyl-(1->6)-glucoside] (S)-Multifidol 2-O-[b-D-apiofuranosyl-(1->6)-b-D-glucopyranoside] (S)-Multifidol 2-O-[b-D-apiosyl-(1->6)-b-D-glucoside] C22H32O13 504.4817 504.18429111 1-(2-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-4,6-dihydroxyphenyl)-2-methylbutan-1-one 1-(2-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-4,6-dihydroxyphenyl)-2-methylbutan-1-one 467437-62-3 CCC(C)C(=O)C1=C(O)C=C(O)C=C1OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O InChI=1S/C22H32O13/c1-3-9(2)15(26)14-11(25)4-10(24)5-12(14)34-20-18(29)17(28)16(27)13(35-20)6-32-21-19(30)22(31,7-23)8-33-21/h4-5,9,13,16-21,23-25,27-31H,3,6-8H2,1-2H3 MXXCYHQPSVRPOP-UHFFFAOYSA-N belongs to the class of organic compounds known as phenolic glycosides. These are organic compounds containing a phenolic structure attached to a glycosyl moiety. Some examples of phenolic structures include lignans, and flavonoids. Among the sugar units found in natural glycosides are D-glucose, L-Fructose, and L rhamnose. Phenolic glycosides Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Aromatic heteromonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Acetals Alkyl-phenylketones Aryl alkyl ketones Benzoyl derivatives Butyrophenones Disaccharides Hydrocarbon derivatives O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Phenol ethers Phenoxy compounds Phenylpropanes Polyols Primary alcohols Resorcinols Secondary alcohols Tertiary alcohols Tetrahydrofurans Vinylogous acids 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Acetal Alcohol Alkyl-phenylketone Aromatic heteromonocyclic compound Aryl alkyl ketone Aryl ketone Benzenoid Benzoyl Butyrophenone Disaccharide Hydrocarbon derivative Ketone Monocyclic benzene moiety O-glycosyl compound Organic oxide Organoheterocyclic compound Oxacycle Oxane Phenol Phenol ether Phenolic glycoside Phenoxy compound Phenylketone Phenylpropane Polyol Primary alcohol Resorcinol Secondary alcohol Tertiary alcohol Tetrahydrofuran Vinylogous acid logp -0.83 ALOGPS logs -1.75 ALOGPS solubility 8.89e+00 g/l ALOGPS logp -0.59 ChemAxon pka_strongest_acidic 7.89 ChemAxon pka_strongest_basic -3.1 ChemAxon iupac 1-(2-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-4,6-dihydroxyphenyl)-2-methylbutan-1-one ChemAxon average_mass 504.4817 ChemAxon mono_mass 504.18429111 ChemAxon smiles CCC(C)C(=O)C1=C(O)C=C(O)C=C1OC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1O ChemAxon formula C22H32O13 ChemAxon inchi InChI=1S/C22H32O13/c1-3-9(2)15(26)14-11(25)4-10(24)5-12(14)34-20-18(29)17(28)16(27)13(35-20)6-32-21-19(30)22(31,7-23)8-33-21/h4-5,9,13,16-21,23-25,27-31H,3,6-8H2,1-2H3 ChemAxon inchikey MXXCYHQPSVRPOP-UHFFFAOYSA-N ChemAxon polar_surface_area 215.83 ChemAxon refractivity 115.02 ChemAxon polarizability 49.04 ChemAxon rotatable_bond_count 9 ChemAxon acceptor_count 13 ChemAxon donor_count 8 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::NmrOneD 36982 Specdb::NmrOneD 36983 Specdb::NmrOneD 36984 Specdb::NmrOneD 36985 Specdb::NmrOneD 36986 Specdb::NmrOneD 36987 Specdb::NmrOneD 36988 Specdb::NmrOneD 36989 Specdb::NmrOneD 36990 Specdb::NmrOneD 36991 Specdb::NmrOneD 36992 Specdb::NmrOneD 36993 Specdb::NmrOneD 36994 Specdb::NmrOneD 36995 Specdb::NmrOneD 36996 Specdb::NmrOneD 36997 Specdb::NmrOneD 36998 Specdb::NmrOneD 36999 Specdb::NmrOneD 37000 Specdb::NmrOneD 37001 Specdb::MsMs 105726 Specdb::MsMs 105727 Specdb::MsMs 105728 Specdb::MsMs 172281 Specdb::MsMs 172282 Specdb::MsMs 172283 Specdb::MsMs 2287698 Specdb::MsMs 2287699 Specdb::MsMs 2287700 Specdb::MsMs 2648514 Specdb::MsMs 2648515 Specdb::MsMs 2648516 Specdb::CMs 15632 Specdb::CMs 46646 Specdb::CMs 170199 Specdb::CMs 170201 Specdb::CMs 170203 Specdb::CMs 170205 Specdb::CMs 170207 Specdb::CMs 170209 Specdb::CMs 170212 Specdb::CMs 170214 Specdb::CMs 170216 Specdb::CMs 170218 Specdb::CMs 170220 Specdb::CMs 170222 Specdb::CMs 170223 Specdb::CMs 170226 Specdb::CMs 170228 Specdb::CMs 170231 Specdb::CMs 170233 Specdb::CMs 170235 Specdb::CMs 280666 HMDB39930 #<Reference:0x000055ce326402c0> Fruits Unknown generic