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Obsolete: W9T

Summary
Name:4-O-beta-D-galactopyranosyl-beta-D-fructofuranose
Formula:C12 H22 O11
Formal charge:0
Formula weight:342.296 Da
Component type:saccharide

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-O-beta-D-galactopyranosyl-beta-D-fructofuranose
OpenEye OEToolkits1.7.6(2S,3R,4S,5R,6R)-2-[(2R,3S,4S,5R)-2,5-bis(hydroxymethyl)-4,5-bis(oxidanyl)oxolan-3-yl]oxy-6-(hydroxymethyl)oxane-3,4,5-triol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01OC2C(OC1OC(CO)C(O)C(O)C1O)C(OC2(O)CO)CO
InChIInChI1.03InChI=1S/C12H22O11/c13-1-4-6(16)7(17)8(18)11(21-4)22-9-5(2-14)23-12(20,3-15)10(9)19/h4-11,13-20H,1-3H2/t4-,5-,6+,7+,8-,9-,10+,11+,12-/m1/s1
InChIKeyInChI1.03JCQLYHFGKNRPGE-FCVZTGTOSA-N
SMILES_CANONICALCACTVS3.370OC[C@H]1O[C@@H](O[C@@H]2[C@@H](CO)O[C@](O)(CO)[C@H]2O)[C@H](O)[C@@H](O)[C@H]1O
SMILESCACTVS3.370OC[CH]1O[CH](O[CH]2[CH](CO)O[C](O)(CO)[CH]2O)[CH](O)[CH](O)[CH]1O
SMILES_CANONICALOpenEye OEToolkits1.7.6C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@@]([C@H]2O)(CO)O)CO)O)O)O)O
SMILESOpenEye OEToolkits1.7.6C(C1C(C(C(C(O1)OC2C(OC(C2O)(CO)O)CO)O)O)O)O

218853

PDB entries from 2024-04-24

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