Scopoloside

6-methoxy-7-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

Also Known As: Scopoloside|6-methoxy-2-oxo-2h-chromen-7-yl d-glucopyranoside|6-methoxy-7-[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-2-one

Molecular Formula	C16H18O9
Molecular Weight	354.0951 g/mol
LogP	-1.02
Topological Polar Surface Area	138.82 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	9
Rotatable Bonds	4
Exact Mass	354.0951
Heavy Atoms	25
Complexity	799.8

Chemical Identifiers

CAS Number	5405-90-3
SMILES	COC1=C(C=C2C(=C1)C=CC(=O)O2)OC3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O