1.0 2010-04-08 22:11:50 UTC 2025-11-19 00:54:59 UTC FDB015425 Myricanol 5-glucoside Constituent of Myrica rubra (Chinese bayberry). Myricanol 5-glucoside is found in fruits. Myricanol 5-glucoside Myricanol glucoside Myricanol-15-glucoside C27H36O10 520.5687 520.230847372 2-({11,17-dihydroxy-3,4-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-5-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol 2-({11,17-dihydroxy-3,4-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-5-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol 90052-02-1 COC1=C(OC2OC(CO)C(O)C(O)C2O)C2=CC(=C1OC)C1=C(O)C=CC(CCC(O)CCCC2)=C1 InChI=1S/C27H36O10/c1-34-25-18-12-15(5-3-4-6-16(29)9-7-14-8-10-19(30)17(18)11-14)24(26(25)35-2)37-27-23(33)22(32)21(31)20(13-28)36-27/h8,10-12,16,20-23,27-33H,3-7,9,13H2,1-2H3 NPSYWDNXSMBWKP-UHFFFAOYSA-N belongs to the class of organic compounds known as meta,meta-bridged biphenyls. These are cyclic diarylheptanoids where the two aryl groups are linked to each other by an ether group conjugated to their 3-position. Meta,meta-bridged biphenyls Organic compounds Phenylpropanoids and polyketides Diarylheptanoids Cyclic diarylheptanoids Aromatic heteropolycyclic compounds 1-hydroxy-2-unsubstituted benzenoids Acetals Alkyl aryl ethers Anisoles Hexoses Hydrocarbon derivatives O-glycosyl compounds Oxacyclic compounds Oxanes Phenolic glycosides Polyols Primary alcohols Secondary alcohols 1-hydroxy-2-unsubstituted benzenoid Acetal Alcohol Alkyl aryl ether Anisole Aromatic heteropolycyclic compound Benzenoid Ether Glycosyl compound Hexose monosaccharide Hydrocarbon derivative Meta,meta-bridged biphenyl Monosaccharide O-glycosyl compound Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenolic glycoside Polyol Primary alcohol Secondary alcohol logp 1.42 ALOGPS logs -3.15 ALOGPS solubility 3.70e-01 g/l ALOGPS melting_point Mp 220-223° logp 1.83 ChemAxon pka_strongest_acidic 9.79 ChemAxon pka_strongest_basic -2.7 ChemAxon iupac 2-({11,17-dihydroxy-3,4-dimethoxytricyclo[12.3.1.1²,⁶]nonadeca-1(17),2,4,6(19),14(18),15-hexaen-5-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triol ChemAxon average_mass 520.5687 ChemAxon mono_mass 520.230847372 ChemAxon smiles COC1=C(OC2OC(CO)C(O)C(O)C2O)C2=CC(=C1OC)C1=C(O)C=CC(CCC(O)CCCC2)=C1 ChemAxon formula C27H36O10 ChemAxon inchi InChI=1S/C27H36O10/c1-34-25-18-12-15(5-3-4-6-16(29)9-7-14-8-10-19(30)17(18)11-14)24(26(25)35-2)37-27-23(33)22(32)21(31)20(13-28)36-27/h8,10-12,16,20-23,27-33H,3-7,9,13H2,1-2H3 ChemAxon inchikey NPSYWDNXSMBWKP-UHFFFAOYSA-N ChemAxon polar_surface_area 158.3 ChemAxon refractivity 133.18 ChemAxon polarizability 54.01 ChemAxon rotatable_bond_count 5 ChemAxon acceptor_count 10 ChemAxon donor_count 6 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10250 Specdb::CMs 44895 Specdb::MsMs 45771 Specdb::MsMs 45772 Specdb::MsMs 45773 Specdb::MsMs 145242 Specdb::MsMs 145243 Specdb::MsMs 145244 Specdb::MsMs 2426383 Specdb::MsMs 2426384 Specdb::MsMs 2426385 Specdb::MsMs 2509786 Specdb::MsMs 2509787 Specdb::MsMs 2509788 HMDB0036525 Fruits Unknown generic