1.0 2010-04-08 22:15:28 UTC 2025-11-19 02:35:35 UTC FDB021110 Sesaminol glucosyl-(1->2)-[glucosyl-(1->6)]-glucoside Constituent of sesame seed. Sesaminol glucosyl-(1->2)-[glucosyl-(1->6)]-glucoside is found in cereals and cereal products. Justisolin O-[b-D-glucopyranosyl-(1->2)-[b-D-glucopyranosyl-(1->6)]-b-D-glucopyranoside] Sesaminol glucosyl-(1->2)-[glucosyl-(1->6)]-glucoside Sesaminol O-[b-D-glucopyranosyl-(1->2)-[b-D-glucopyranosyl-(1->6)]-b-D-glucopyranoside] C38H48O22 856.7745 856.26372322 2-{[6-({6-[4-(2H-1,3-benzodioxol-5-yl)-hexahydrofuro[3,4-c]furan-1-yl]-2H-1,3-benzodioxol-5-yl}oxy)-3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol 2-{[6-({6-[4-(2H-1,3-benzodioxol-5-yl)-hexahydrofuro[3,4-c]furan-1-yl]-2H-1,3-benzodioxol-5-yl}oxy)-3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol 157469-83-5 OCC1OC(OCC2OC(OC3=CC4=C(OCO4)C=C3C3OCC4C3COC4C3=CC4=C(OCO4)C=C3)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O InChI=1S/C38H48O22/c39-6-22-25(41)28(44)31(47)36(57-22)51-10-24-27(43)30(46)35(60-37-32(48)29(45)26(42)23(7-40)58-37)38(59-24)56-18-5-21-20(54-12-55-21)4-14(18)34-16-9-49-33(15(16)8-50-34)13-1-2-17-19(3-13)53-11-52-17/h1-5,15-16,22-48H,6-12H2 IJZGFTCXUSMUHI-UHFFFAOYSA-N belongs to the class of organic compounds known as oligosaccharides. These are carbohydrates made up of 3 to 10 monosaccharide units linked to each other through glycosidic bonds. Oligosaccharides Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates Aromatic heteropolycyclic compounds Acetals Benzenoids Benzodioxoles Dialkyl ethers Furofuran lignans Furofurans Hydrocarbon derivatives Lignan glycosides O-glycosyl compounds Oxacyclic compounds Oxanes Phenolic glycosides Polyols Primary alcohols Secondary alcohols Tetrahydrofurans Acetal Alcohol Aromatic heteropolycyclic compound Benzenoid Benzodioxole Dialkyl ether Ether Furanoid lignan Furofuran Furofuran lignan skeleton Glycosyl compound Hydrocarbon derivative Lignan glycoside O-glycosyl compound Oligosaccharide Organoheterocyclic compound Oxacycle Oxane Phenolic glycoside Polyol Primary alcohol Secondary alcohol Tetrahydrofuran logp -1.02 ALOGPS logs -1.89 ALOGPS solubility 1.11e+01 g/l ALOGPS logp -3.7 ChemAxon pka_strongest_acidic 11.85 ChemAxon pka_strongest_basic -3.6 ChemAxon iupac 2-{[6-({6-[4-(2H-1,3-benzodioxol-5-yl)-hexahydrofuro[3,4-c]furan-1-yl]-2H-1,3-benzodioxol-5-yl}oxy)-3,4-dihydroxy-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol ChemAxon average_mass 856.7745 ChemAxon mono_mass 856.26372322 ChemAxon smiles OCC1OC(OCC2OC(OC3=CC4=C(OCO4)C=C3C3OCC4C3COC4C3=CC4=C(OCO4)C=C3)C(OC3OC(CO)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O ChemAxon formula C38H48O22 ChemAxon inchi InChI=1S/C38H48O22/c39-6-22-25(41)28(44)31(47)36(57-22)51-10-24-27(43)30(46)35(60-37-32(48)29(45)26(42)23(7-40)58-37)38(59-24)56-18-5-21-20(54-12-55-21)4-14(18)34-16-9-49-33(15(16)8-50-34)13-1-2-17-19(3-13)53-11-52-17/h1-5,15-16,22-48H,6-12H2 ChemAxon inchikey IJZGFTCXUSMUHI-UHFFFAOYSA-N ChemAxon polar_surface_area 313.06 ChemAxon refractivity 188.7 ChemAxon polarizability 83.41 ChemAxon rotatable_bond_count 11 ChemAxon acceptor_count 22 ChemAxon donor_count 10 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon Specdb::MsMs 9599 Specdb::MsMs 9600 Specdb::MsMs 9601 Specdb::MsMs 16271 Specdb::MsMs 16272 Specdb::MsMs 16273 Specdb::MsMs 2684574 Specdb::MsMs 2684575 Specdb::MsMs 2684576 Specdb::MsMs 3024603 Specdb::MsMs 3024604 Specdb::MsMs 3024605 Specdb::NmrOneD 45422 Specdb::NmrOneD 45423 Specdb::NmrOneD 45424 Specdb::NmrOneD 45425 Specdb::NmrOneD 45426 Specdb::NmrOneD 45427 Specdb::NmrOneD 45428 Specdb::NmrOneD 45429 Specdb::NmrOneD 45430 Specdb::NmrOneD 45431 Specdb::NmrOneD 45432 Specdb::NmrOneD 45433 Specdb::NmrOneD 45434 Specdb::NmrOneD 45435 Specdb::NmrOneD 45436 Specdb::NmrOneD 45437 Specdb::NmrOneD 45438 Specdb::NmrOneD 45439 Specdb::NmrOneD 45440 Specdb::NmrOneD 45441 HMDB41211 #<Reference:0x000055ce328b1838> Breakfast cereal Type 2 specific Cereals and cereal products Unknown generic