Catalog Number:
AG007BY0
Chemical Name:
5-Bromo-4-chloro-3-indolyl-alpha-d-glucopyranoside
CAS Number:
108789-36-2
Molecular Formula:
C14H15BrClNO6
Molecular Weight:
408.6290
MDL Number:
MFCD00155606
IUPAC Name:
(2R,3R,4S,5S,6R)-2-[(5-bromo-4-chloro-1H-indol-3-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
InChI:
InChI=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
InChI Key:
OPIFSICVWOWJMJ-HRNXZZBMSA-N
SMILES:
OC[C@H]1O[C@H](Oc2c[nH]c3c2c(Cl)c(cc3)Br)[C@@H]([C@H]([C@@H]1O)O)O
