Glycoside
...
GD034383

Name:
None

Formula:
C32H40O9

Smiles:
CCc1ccc([C@@H]2O[C@H](COC(=O)OCC3CC4CCC3C4)[C@H](O)[C@H](O)[C@H]2O)cc1Cc1ccc2c(c1)OCCO2

Aglycone:
CCc1ccccc1Cc1ccc2c(c1)OCCO2.COC(=O)OCC1CC2CCC1C2

Sugarmoiety:
OC1OC(O)C(O)C(O)C1O

Other Identifiers

Properties
HBA: 9 RingCount: 6
HBD: 3 FractionCSP3: 0.59
AlogP: 3.72 Num_rotatable_bonds: 8
MolWt: 568.66 Num_heavy_atoms: 41
TPSA: 123.91 NumAromaticRings: 2

Unique Aglycone
AD10455
Formula: C17H18O2

Smiles:
CCc1ccccc1Cc1ccc2c(c1)OCCO2
HBA: 2 RingCount: 3
HBD: 0 FractionCSP3: 0.29
AlogP: 3.61 Num_rotatable_bonds: 3
MolWt: 254.33 Num_heavy_atoms: 19
TPSA: 18.46 NumAromaticRings: 2
AD21867
Formula: C10H16O3

Smiles:
COC(=O)OCC1CC2CCC1C2
HBA: 3 RingCount: 2
HBD: 0 FractionCSP3: 0.9
AlogP: 2.21 Num_rotatable_bonds: 2
MolWt: 184.23 Num_heavy_atoms: 13
TPSA: 35.53 NumAromaticRings: 0

Sugarmoiety
SD00017

OC1OC(O)C(O)C(O)C1O