1.0 2016-10-03 18:22:44 UTC 2020-04-22 15:45:54 UTC BMDB0011677 BMDB11677 Galactose-beta-1,4-xylose Gal(b1-4)b-xyl WURCS=2.0/2,2,1/[a212h-1b_1-5][a2112h-1b_1-5]/1-2/a4-b1 Galactose-b-1,4-xylose Galactose-β-1,4-xylose Galactosyl-1,4-xylose C11H20O10 312.2705 312.10564686 (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-{[(3R,4R,5R,6R)-4,5,6-trihydroxyoxan-3-yl]oxy}oxane-3,4,5-triol (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-{[(3R,4R,5R,6R)-4,5,6-trihydroxyoxan-3-yl]oxy}oxane-3,4,5-triol OC[C@H]1O[C@@H](O[C@@H]2CO[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O InChI=1S/C11H20O10/c12-1-3-5(13)7(15)9(17)11(20-3)21-4-2-19-10(18)8(16)6(4)14/h3-18H,1-2H2/t3-,4-,5+,6+,7+,8-,9-,10-,11+/m1/s1 VCTBNHVCBSUQPG-YOUNRWHRSA-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. Organic compounds Organic oxygen compounds Organooxygen compounds Carbohydrates and carbohydrate conjugates O-glycosyl compounds Acetals Disaccharides Hemiacetals Hydrocarbon derivatives Oxacyclic compounds Oxanes Polyols Primary alcohols Secondary alcohols Acetal Alcohol Aliphatic heteromonocyclic compound Disaccharide Hemiacetal Hydrocarbon derivative O-glycosyl compound Organoheterocyclic compound Oxacycle Oxane Polyol Primary alcohol Secondary alcohol Aliphatic heteromonocyclic compounds Solid logp -2.96 ALOGPS logs 0.27 ALOGPS logp -4.1 ChemAxon pka_strongest_acidic 11.26 ChemAxon pka_strongest_basic -3 ChemAxon iupac (2R,3R,4S,5R,6S)-2-(hydroxymethyl)-6-{[(3R,4R,5R,6R)-4,5,6-trihydroxyoxan-3-yl]oxy}oxane-3,4,5-triol ChemAxon average_mass 312.2705 ChemAxon mono_mass 312.10564686 ChemAxon smiles OC[C@H]1O[C@@H](O[C@@H]2CO[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O ChemAxon formula C11H20O10 ChemAxon inchi InChI=1S/C11H20O10/c12-1-3-5(13)7(15)9(17)11(20-3)21-4-2-19-10(18)8(16)6(4)14/h3-18H,1-2H2/t3-,4-,5+,6+,7+,8-,9-,10-,11+/m1/s1 ChemAxon inchikey VCTBNHVCBSUQPG-YOUNRWHRSA-N ChemAxon polar_surface_area 169.3 ChemAxon refractivity 62.37 ChemAxon polarizability 28.9 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 10 ChemAxon donor_count 7 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon number_of_rings 2 ChemAxon bioavailability 1 ChemAxon rule_of_five Yes ChemAxon ghose_filter Yes ChemAxon veber_rule Yes ChemAxon mddr_like_rule Yes ChemAxon Specdb::MsMs 310438 Specdb::MsMs 310439 Specdb::MsMs 310440 Specdb::MsMs 355159 Specdb::MsMs 355160 Specdb::MsMs 355161 Specdb::MsMs 2816374 Specdb::MsMs 2816375 Specdb::MsMs 2816376 Specdb::MsMs 2892782 Specdb::MsMs 2892783 Specdb::MsMs 2892784 Specdb::NmrOneD 150970 Specdb::NmrOneD 150971 Specdb::NmrOneD 150972 Specdb::NmrOneD 150973 Specdb::NmrOneD 150974 Specdb::NmrOneD 150975 Specdb::NmrOneD 150976 Specdb::NmrOneD 150977 Specdb::NmrOneD 150978 Specdb::NmrOneD 150979 Specdb::NmrOneD 150980 Specdb::NmrOneD 150981 Specdb::NmrOneD 150982 Specdb::NmrOneD 150983 Specdb::NmrOneD 150984 Specdb::NmrOneD 150985 Specdb::NmrOneD 150986 Specdb::NmrOneD 150987 Specdb::NmrOneD 150988 Specdb::NmrOneD 150989 Specdb::CMs 19958 Specdb::CMs 39760 Specdb::CMs 134905 Specdb::CMs 142639 Specdb::CMs 147135 Specdb::CMs 147137 Specdb::CMs 147139 Specdb::CMs 147141 Specdb::CMs 147143 Specdb::CMs 147145 Specdb::CMs 147147 Specdb::CMs 147149 Specdb::CMs 147151 Specdb::CMs 147153 Specdb::CMs 147155 Specdb::CMs 147157 Specdb::CMs 279585 FDB028365 53481024 30776595 145637