1.0 2010-04-08 22:13:55 UTC 2019-11-26 03:16:39 UTC FDB018766 Verbasoside Isolated from Stachys sieboldii (Chinese artichoke). Verbasoside is found in root vegetables. Decaffeoylverbascoside Dicaffeoylacteoside Verbasoside C20H30O12 462.445 462.173726424 2-({2-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl}oxy)-6-methyloxane-3,4,5-triol 2-({2-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl}oxy)-6-methyloxane-3,4,5-triol 61548-34-3 CC1OC(OC2C(O)C(CO)OC(OCCC3=CC(O)=C(O)C=C3)C2O)C(O)C(O)C1O InChI=1S/C20H30O12/c1-8-13(24)15(26)16(27)20(30-8)32-18-14(25)12(7-21)31-19(17(18)28)29-5-4-9-2-3-10(22)11(23)6-9/h2-3,6,8,12-28H,4-5,7H2,1H3 DORPKYRPJIIARM-UHFFFAOYSA-N belongs to the class of organic compounds known as o-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a O-glycosidic bond. O-glycosyl compounds 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 Benzene and substituted derivatives Catechols Disaccharides Hydrocarbon derivatives Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Tyrosols and derivatives 1-hydroxy-2-unsubstituted benzenoid 1-hydroxy-4-unsubstituted benzenoid Acetal Alcohol Aromatic heteromonocyclic compound Benzenoid Catechol Disaccharide Hydrocarbon derivative Monocyclic benzene moiety O-glycosyl compound Organoheterocyclic compound Oxacycle Oxane Phenol Polyol Primary alcohol Secondary alcohol Tyrosol derivative logp -1.35 ALOGPS logs -1.51 ALOGPS solubility 1.44e+01 g/l ALOGPS logp -1.6 ChemAxon pka_strongest_acidic 9.45 ChemAxon pka_strongest_basic -3 ChemAxon iupac 2-({2-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl}oxy)-6-methyloxane-3,4,5-triol ChemAxon average_mass 462.445 ChemAxon mono_mass 462.173726424 ChemAxon smiles CC1OC(OC2C(O)C(CO)OC(OCCC3=CC(O)=C(O)C=C3)C2O)C(O)C(O)C1O ChemAxon formula C20H30O12 ChemAxon inchi InChI=1S/C20H30O12/c1-8-13(24)15(26)16(27)20(30-8)32-18-14(25)12(7-21)31-19(17(18)28)29-5-4-9-2-3-10(22)11(23)6-9/h2-3,6,8,12-28H,4-5,7H2,1H3 ChemAxon inchikey DORPKYRPJIIARM-UHFFFAOYSA-N ChemAxon polar_surface_area 198.76 ChemAxon refractivity 104.87 ChemAxon polarizability 44.78 ChemAxon rotatable_bond_count 7 ChemAxon acceptor_count 12 ChemAxon donor_count 8 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 80511 Specdb::MsMs 80512 Specdb::MsMs 80513 Specdb::MsMs 141402 Specdb::MsMs 141403 Specdb::MsMs 141404 Specdb::MsMs 2807486 Specdb::MsMs 2807487 Specdb::MsMs 2807488 Specdb::MsMs 2898696 Specdb::MsMs 2898697 Specdb::MsMs 2898698 Specdb::CMs 19533 Specdb::CMs 46325 Specdb::CMs 131011 Specdb::CMs 138745 Specdb::NmrOneD 31742 Specdb::NmrOneD 31743 Specdb::NmrOneD 31744 Specdb::NmrOneD 31745 Specdb::NmrOneD 31746 Specdb::NmrOneD 31747 Specdb::NmrOneD 31748 Specdb::NmrOneD 31749 Specdb::NmrOneD 31750 Specdb::NmrOneD 31751 Specdb::NmrOneD 31752 Specdb::NmrOneD 31753 Specdb::NmrOneD 31754 Specdb::NmrOneD 31755 Specdb::NmrOneD 31756 Specdb::NmrOneD 31757 Specdb::NmrOneD 31758 Specdb::NmrOneD 31759 Specdb::NmrOneD 31760 Specdb::NmrOneD 31761 HMDB39233 #<Reference:0x000055ce33050670> Root vegetables Unknown generic