Glycoside
...
GD013992

Name:
7-[(3,5-dihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}-4-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]oxan-2-yl)oxy]-5,6-dimethoxy-3-(4-methoxyphenyl)-4H-chromen-4-one

Formula:
C42H56O24

Smiles:
COc1ccc(-c2coc3cc(O[C@@H]4O[C@H](CO[C@@H]5O[C@H](C)[C@H](O)[C@H](O)[C@H]5O)[C@H](O)[C@H](O[C@@H]5O[C@H](CO[C@@H]6O[C@H](C)[C@H](O)[C@H](O)[C@H]6O)[C@H](O)[C@H](O)[C@H]5O)[C@H]4O)c(OC)c(OC)c3c2=O)cc1

Aglycone:
COc1ccc(-c2coc3cc(O)c(OC)c(OC)c3c2=O)cc1

Sugarmoiety:
CC1OC(OCC2OC(OC3C(O)C(O)OC(COC4OC(C)C(O)C(O)C4O)C3O)C(O)C(O)C2O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 24 RingCount: 7
HBD: 11 FractionCSP3: 0.64
AlogP: -3.81 Num_rotatable_bonds: 14
MolWt: 944.89 Num_heavy_atoms: 66
TPSA: 354.27 NumAromaticRings: 3

Unique Aglycone
AD09485
Formula: C18H16O6

Smiles:
COc1ccc(-c2coc3cc(O)c(OC)c(OC)c3c2=O)cc1
HBA: 6 RingCount: 3
HBD: 1 FractionCSP3: 0.17
AlogP: 3.19 Num_rotatable_bonds: 4
MolWt: 328.32 Num_heavy_atoms: 24
TPSA: 78.13 NumAromaticRings: 3

Sugarmoiety
SD01877

CC1OC(OCC2OC(OC3C(O)C(O)OC(COC4OC(C)C(O)C(O)C4O)C3O)C(O)C(O)C2O)C(O)C(O)C1O