Catalog Number:
AG000173
Chemical Name:
Benzoic acid, 2-(β-D-glucopyranosyloxy)-, methyl ester
CAS Number:
10019-60-0
Molecular Formula:
C14H18O8
Molecular Weight:
314.2879
MDL Number:
MFCD08703770
IUPAC Name:
methyl 2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzoate
InChI:
InChI=1S/C14H18O8/c1-20-13(19)7-4-2-3-5-8(7)21-14-12(18)11(17)10(16)9(6-15)22-14/h2-5,9-12,14-18H,6H2,1H3/t9-,10-,11+,12-,14-/m1/s1
InChI Key:
ONKIQNFPVXNOBV-YGEZULPYSA-N
SMILES:
OC[C@H]1O[C@@H](Oc2ccccc2C(=O)OC)[C@@H]([C@H]([C@@H]1O)O)O
