Glycoside
...
GD037096

Name:
None

Formula:
C31H42O15

Smiles:
COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(OC)c(OC)c2OC)c(OC)c(OC)c1OC

Aglycone:
COc1cc(C2OCC3C(c4cc(O)c(OC)c(OC)c4OC)OCC23)c(OC)c(OC)c1OC

Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 15 RingCount: 5
HBD: 4 FractionCSP3: 0.61
AlogP: 1.0 Num_rotatable_bonds: 12
MolWt: 654.66 Num_heavy_atoms: 46
TPSA: 182.45 NumAromaticRings: 2

Unique Aglycone
AD23394
Formula: C25H32O10

Smiles:
COc1cc(C2OCC3C(c4cc(O)c(OC)c(OC)c4OC)OCC23)c(OC)c(OC)c1OC
HBA: 10 RingCount: 4
HBD: 1 FractionCSP3: 0.52
AlogP: 3.53 Num_rotatable_bonds: 9
MolWt: 492.52 Num_heavy_atoms: 35
TPSA: 103.3 NumAromaticRings: 2

Sugarmoiety
SD00003

OCC1OC(O)C(O)C(O)C1O