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Obsolete: BXP

Summary
Name:4-O-beta-D-xylopyranosyl-beta-D-xylopyranose
Synonyms:XYLOBIOSE
Formula:C10 H18 O9
Formal charge:0
Formula weight:282.245 Da
Component type:saccharide

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-O-beta-D-xylopyranosyl-beta-D-xylopyranose
OpenEye OEToolkits1.7.6(2S,3R,4S,5R)-2-[(3R,4R,5R,6R)-4,5,6-tris(oxidanyl)oxan-3-yl]oxyoxane-3,4,5-triol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01O(C1COC(O)C(O)C1O)C2OCC(O)C(O)C2O
InChIInChI1.03InChI=1S/C10H18O9/c11-3-1-18-10(8(15)5(3)12)19-4-2-17-9(16)7(14)6(4)13/h3-16H,1-2H2/t3-,4-,5+,6+,7-,8-,9-,10+/m1/s1
InChIKeyInChI1.03LGQKSQQRKHFMLI-SJYYZXOBSA-N
SMILES_CANONICALCACTVS3.370O[C@@H]1CO[C@@H](O[C@@H]2CO[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
SMILESCACTVS3.370O[CH]1CO[CH](O[CH]2CO[CH](O)[CH](O)[CH]2O)[CH](O)[CH]1O
SMILES_CANONICALOpenEye OEToolkits1.7.6C1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2CO[C@H]([C@@H]([C@H]2O)O)O)O)O)O
SMILESOpenEye OEToolkits1.7.6C1C(C(C(C(O1)OC2COC(C(C2O)O)O)O)O)O

218500

PDB entries from 2024-04-17

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