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5-bromo-4-chloro-1H-indol-3-yl alpha-D-mannopyranoside


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Chemical Component Summary

Name5-bromo-4-chloro-1H-indol-3-yl alpha-D-mannopyranoside
Synonyms(2R,3S,4S,5S,6R)-2-(5-BROMO-4-CHLORO-1H-INDOL-3-YLOXY)-TETRAHYDRO-6-(HYDROXYMETHYL)-2H-PYRAN-3,4,5-TRIOL; (5-BROMO-4-CHLORO-3-INDOLYL)-Alpha-D-MANNOSE; 5-bromo-4-chloro-1H-indol-3-yl alpha-D-mannoside; 5-bromo-4-chloro-1H-indol-3-yl D-mannoside; 5-bromo-4-chloro-1H-indol-3-yl mannoside
Identifiers(2R,3S,4S,5S,6R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
FormulaC14 H15 Br Cl N O6
Molecular Weight408.629
TypeD-SACCHARIDE
Isomeric SMILESc1cc(c(c2c1[nH]cc2O[C@@H]3[C@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)Cl)Br
InChIInChI=1S/C14H15BrClNO6/c15-5-1-2-6-9(10(5)16)7(3-17-6)22-14-13(21)12(20)11(19)8(4-18)23-14/h1-3,8,11-14,17-21H,4H2/t8-,11-,12+,13+,14+/m1/s1
InChIKeyOPIFSICVWOWJMJ-HAAGFXOZSA-N

Chemical Details

Formal Charge0
Atom Count38
Chiral Atom Count5
Bond Count40
Aromatic Bond Count10

Drug Info: DrugBank

DrugBank IDDB04806 
Name(5-BROMO-4-CHLORO-3-INDOLYL)-A-D-MANNOSE
Groups experimental
Synonyms(5-BROMO-4-CHLORO-3-INDOLYL)-A-D-MANNOSE

Related Resource References

Resource NameReference
PubChem 5289587
ChEBI CHEBI:75501