1.0 2010-04-08 22:11:06 UTC 2025-11-19 00:44:03 UTC FDB014129 2''-Methoxy-(S)-oleuropein Constituent of Jasminum officinale variety grandiflorum (royal jasmine). 2''-Methoxy-(S)-oleuropein is found in tea and herbs and spices. 2''-Methoxy-(S)-oleuropein b-Methoxy-(S)-oleuropein beta-Methoxy-(S)-oleuropein C26H34O14 570.5398 570.194855796 methyl (2S,3E,4S)-4-{2-[(2S)-2-(3,4-dihydroxyphenyl)-2-methoxyethoxy]-2-oxoethyl}-3-ethylidene-2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylate methyl (4S,5E,6S)-4-{2-[(2S)-2-(3,4-dihydroxyphenyl)-2-methoxyethoxy]-2-oxoethyl}-5-ethylidene-6-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6-dihydropyran-3-carboxylate 256498-10-9 [H][C@]1(CC(=O)OC[C@@H](OC)C2=CC(O)=C(O)C=C2)\C(=C/C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C1C(=O)OC InChI=1S/C26H34O14/c1-4-13-14(8-20(30)37-11-19(35-2)12-5-6-16(28)17(29)7-12)15(24(34)36-3)10-38-25(13)40-26-23(33)22(32)21(31)18(9-27)39-26/h4-7,10,14,18-19,21-23,25-29,31-33H,8-9,11H2,1-3H3/b13-4+/t14-,18+,19+,21+,22-,23+,25-,26-/m0/s1 YZPLQRBBARLPFK-RUICJLPMSA-N belongs to the class of organic compounds known as terpene glycosides. These are prenol lipids containing a carbohydrate moiety glycosidically bound to a terpene backbone. Terpene glycosides Organic compounds Lipids and lipid-like molecules Prenol lipids Terpene glycosides Aromatic heteromonocyclic compounds 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Acetals Aromatic monoterpenoids Benzylethers Carbonyl compounds Catechols Dialkyl ethers Dicarboxylic acids and derivatives Enoate esters Hydrocarbon derivatives Iridoids and derivatives Methyl esters Monocyclic monoterpenoids Monosaccharides O-glycosyl compounds Organic oxides Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Sugar acids and derivatives Vinylogous esters 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Acetal Alcohol Alpha,beta-unsaturated carboxylic ester Aromatic heteromonocyclic compound Aromatic monoterpenoid Benzenoid Benzylether Carbonyl group Carboxylic acid derivative Carboxylic acid ester Catechol Dialkyl ether Dicarboxylic acid or derivatives Enoate ester Ether Glycosyl compound Hydrocarbon derivative Methyl ester Monocyclic benzene moiety Monocyclic monoterpenoid Monosaccharide Monoterpenoid O-glycosyl compound Organic oxide Organic oxygen compound Organoheterocyclic compound Organooxygen compound Oxacycle Oxane Phenol Polyol Primary alcohol Secoiridoid-skeleton Secondary alcohol Sugar acid Terpene glycoside Vinylogous ester logp 0.45 ALOGPS logs -2.85 ALOGPS solubility 8.02e-01 g/l ALOGPS logp -0.16 ChemAxon pka_strongest_acidic 9.21 ChemAxon pka_strongest_basic -3 ChemAxon iupac methyl (2S,3E,4S)-4-{2-[(2S)-2-(3,4-dihydroxyphenyl)-2-methoxyethoxy]-2-oxoethyl}-3-ethylidene-2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2H-pyran-5-carboxylate ChemAxon average_mass 570.5398 ChemAxon mono_mass 570.194855796 ChemAxon smiles [H][C@]1(CC(=O)OC[C@@H](OC)C2=CC(O)=C(O)C=C2)\C(=C/C)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)OC=C1C(=O)OC ChemAxon formula C26H34O14 ChemAxon inchi InChI=1S/C26H34O14/c1-4-13-14(8-20(30)37-11-19(35-2)12-5-6-16(28)17(29)7-12)15(24(34)36-3)10-38-25(13)40-26-23(33)22(32)21(31)18(9-27)39-26/h4-7,10,14,18-19,21-23,25-29,31-33H,8-9,11H2,1-3H3/b13-4+/t14-,18+,19+,21+,22-,23+,25-,26-/m0/s1 ChemAxon inchikey YZPLQRBBARLPFK-RUICJLPMSA-N ChemAxon polar_surface_area 210.9 ChemAxon refractivity 134.18 ChemAxon polarizability 55.14 ChemAxon rotatable_bond_count 12 ChemAxon acceptor_count 12 ChemAxon donor_count 6 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 91248 Specdb::MsMs 91249 Specdb::MsMs 91250 Specdb::MsMs 154590 Specdb::MsMs 154591 Specdb::MsMs 154592 HMDB35445 #<Reference:0x000055ce331b0c40> Black tea Type 1 Green tea Type 1 Herbal tea Type 1 Herbs and Spices Unknown generic Red tea Type 1 Tea Type 1 specific Camellia sinensis 4442