1.02020-04-20 17:35:18 UTC2020-04-21 18:02:34 UTCFDB1121882-O-a-L-Fucopyranosyl-galactoseC12H22O10326.2971326.121296924(2R,3S,4S,5R)-3,4,5,6-tetrahydroxy-2-{[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}hexanalblood group H disaccharideC[C@@H]1O[C@@H](O[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO)[C@@H](O)[C@H](O)[C@@H]1OInChI=1S/C12H22O10/c1-4-7(16)10(19)11(20)12(21-4)22-6(3-14)9(18)8(17)5(15)2-13/h3-13,15-20H,2H2,1H3/t4-,5+,6-,7+,8-,9+,10+,11-,12-/m0/s1BQEBASLZIGFWEU-YYXBYDBJSA-N belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol.Fatty acyl glycosides of mono- and disaccharidesOrganic compoundsLipids and lipid-like moleculesFatty AcylsFatty acyl glycosidesAliphatic heteromonocyclic compoundsAcetalsAlkyl glycosidesBeta-hydroxy aldehydesDisaccharidesFatty alcoholsHydrocarbon derivativesO-glycosyl compoundsOrganic oxidesOxacyclic compoundsOxanesPolyolsPrimary alcoholsSecondary alcoholsAcetalAlcoholAldehydeAliphatic heteromonocyclic compoundAlkyl glycosideBeta-hydroxy aldehydeCarbonyl groupDisaccharideFatty acyl glycoside of mono- or disaccharideFatty alcoholGlycosyl compoundHydrocarbon derivativeO-glycosyl compoundOrganic oxideOrganic oxygen compoundOrganoheterocyclic compoundOrganooxygen compoundOxacycleOxanePolyolPrimary alcoholSecondary alcoholglycosylgalactoselogp-2.20logs-0.19solubility2.10e+02 g/llogp-4.3pka_strongest_acidic12.07pka_strongest_basic-3iupac(2R,3S,4S,5R)-3,4,5,6-tetrahydroxy-2-{[(2S,3S,4R,5S,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}hexanalaverage_mass326.2971mono_mass326.121296924smilesC[C@@H]1O[C@@H](O[C@@H](C=O)[C@@H](O)[C@@H](O)[C@H](O)CO)[C@@H](O)[C@H](O)[C@@H]1OformulaC12H22O10inchiInChI=1S/C12H22O10/c1-4-7(16)10(19)11(20)12(21-4)22-6(3-14)9(18)8(17)5(15)2-13/h3-13,15-20H,2H2,1H3/t4-,5+,6-,7+,8-,9+,10+,11-,12-/m0/s1inchikeyBQEBASLZIGFWEU-YYXBYDBJSA-Npolar_surface_area177.14refractivity68.22polarizability30.41rotatable_bond_count7acceptor_count10donor_count7physiological_charge0formal_charge0Specdb::CMs12064Specdb::CMs39048Specdb::CMs167348Specdb::NmrOneD81232Specdb::NmrOneD81233Specdb::NmrOneD81234Specdb::NmrOneD81235Specdb::NmrOneD81236Specdb::NmrOneD81237Specdb::NmrOneD81238Specdb::NmrOneD81239Specdb::NmrOneD81240Specdb::NmrOneD81241Specdb::NmrOneD81242Specdb::NmrOneD81243Specdb::NmrOneD81244Specdb::NmrOneD81245Specdb::NmrOneD81246Specdb::NmrOneD81247Specdb::NmrOneD81248Specdb::NmrOneD81249Specdb::NmrOneD81250Specdb::NmrOneD81251Specdb::MsMs292573Specdb::MsMs292574Specdb::MsMs292575Specdb::MsMs332821Specdb::MsMs332822Specdb::MsMs332823Specdb::MsMs2731378Specdb::MsMs2731379Specdb::MsMs2731380Specdb::MsMs2977232Specdb::MsMs2977233Specdb::MsMs2977234AnatidaeType 1specificAnatidae8830BeefaloType 1specificBos taurus X Bison bison297284BisonType 1specificBison bison9901BuffaloType 1specificBubalus bubalis89462Cattle (Beef, Veal)Type 1specificBos taurus9913ChickenType 1specificGallus gallus9031Columbidae (Dove, Pigeon)Type 1specificColumbidae8930DeerType 1specificCervidae9850Domestic goatType 1specificCapra aegagrus hircus9925Domestic pigType 1specificSus scrofa domestica9825ElkType 1specificCervus canadensis1574408EmuType 1specificDromaius novaehollandiae8790European rabbitType 1specificOryctolagus9984Greylag gooseType 1specificAnser anser8843Guinea henType 1specificNumida meleagris8996HorseType 1specificEquus caballus9796Mallard duckType 1specificAnas platyrhynchos8839Mountain hareType 1specificLepus timidus62621Mule deerType 1specificOdocoileus9871OstrichType 1specificStruthio camelus8801PheasantType 1specificPhasianus colchicus9054QuailType 1specificPhasianidae9005RabbitType 1specificLeporidae9979Rock ptarmiganType 1specificLagopus muta64668Sheep (Mutton, Lamb)Type 1specificOvis aries9940SquabType 1specificColumba8931TurkeyType 1specificMeleagris gallopavo9103Velvet duckType 1specificMelanitta fusca371864Wild boarType 1specificSus scrofa9823