ST056298 7-[(2S,4S,5S,3R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)(2H-3,4,5,6-tetrahydropy ran-2-yloxy)]-5,6-dihydroxy-2-phenylchromen-4-one, hydrate

Formula: C21H22O11

MW: 450.4

CAS: 206752-33-2

MDL: MFCD06668049

TNP: TNP00115

LogP: 0.39

LogS: -2.62

Acceptors: 11

Donors: 8

Rotation Bonds: 4

Chiral Centers: 5

N+O: 11

LIPINSKY: 2

IUPAC: 7-[(2S,4S,5S,3R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)(2H-3,4,5,6-tetrahydropy ran-2-yloxy)]-5,6-dihydroxy-2-phenylchromen-4-one, hydrate

Smiles: c12c(cc(c3ccccc3)oc2cc(O[C@H]2[C@@H]([C@@H](O)[C@@H]([C@H](O2)CO)O)O)c(c1O)O)=O.O

Chemical Compounds - Natural Compounds