Glycoside
...
GD123147

Name:
3-(2H-1,3-benzodioxol-5-yl)-7-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-5-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4-dihydroxyoxan-2-yl]oxy}-5,6-dimethoxy-4H-chromen-4-one

Formula:
C40H50O25

Smiles:
COc1c(OC2OC(COC3OCC(O)(CO)C3O)C(OC3OC(COC4OCC(O)(CO)C4O)C(O)C(O)C3O)C(O)C2O)cc2occ(-c3ccc4c(c3)OCO4)c(=O)c2c1OC

Aglycone:
COc1c(O)cc2occ(-c3ccc4c(c3)OCO4)c(=O)c2c1OC

Sugarmoiety:
OCC1(O)COC(OCC2OC(OC3C(COC4OCC(O)(CO)C4O)OC(O)C(O)C3O)C(O)C(O)C2O)C1O

Other Identifiers

Properties
HBA: 25 RingCount: 8
HBD: 11 FractionCSP3: 0.62
AlogP: -4.86 Num_rotatable_bonds: 15
MolWt: 930.82 Num_heavy_atoms: 65
TPSA: 363.5 NumAromaticRings: 3

Unique Aglycone
AD49232
Formula: C18H14O7

Smiles:
COc1c(O)cc2occ(-c3ccc4c(c3)OCO4)c(=O)c2c1OC
HBA: 7 RingCount: 4
HBD: 1 FractionCSP3: 0.17
AlogP: 2.91 Num_rotatable_bonds: 3
MolWt: 342.3 Num_heavy_atoms: 25
TPSA: 87.36 NumAromaticRings: 3

Sugarmoiety
SD06093

OCC1(O)COC(OCC2OC(OC3C(COC4OCC(O)(CO)C4O)OC(O)C(O)C3O)C(O)C(O)C2O)C1O