Glycoside
...
GD021272

Name:
NUDANPINOSIDE H

Formula:
C30H32O13

Smiles:
C[C@@]12C[C@]3(O)OC(O1)[C@]1(COC(=O)c4ccccc4)[C@H]3C[C@]21O[C@@H]1O[C@H](COC(=O)c2ccc(O)cc2)[C@H](O)[C@H](O)[C@H]1O

Aglycone:
CC12CC3(O)OC(O1)C1(COC(=O)c4ccccc4)C3CC21O.COC(=O)c1ccc(O)cc1

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

Other Identifiers

Properties
HBA: 13 RingCount: 9
HBD: 5 FractionCSP3: 0.53
AlogP: 0.21 Num_rotatable_bonds: 8
MolWt: 600.57 Num_heavy_atoms: 43
TPSA: 190.67 NumAromaticRings: 2

Unique Aglycone
AD00517
Formula: C8H8O3

Smiles:
COC(=O)c1ccc(O)cc1
HBA: 3 RingCount: 1
HBD: 1 FractionCSP3: 0.12
AlogP: 1.18 Num_rotatable_bonds: 1
MolWt: 152.15 Num_heavy_atoms: 11
TPSA: 46.53 NumAromaticRings: 1
AD00766
Formula: C17H18O6

Smiles:
CC12CC3(O)OC(O1)C1(COC(=O)c4ccccc4)C3CC21O
HBA: 6 RingCount: 7
HBD: 2 FractionCSP3: 0.59
AlogP: 0.82 Num_rotatable_bonds: 3
MolWt: 318.33 Num_heavy_atoms: 23
TPSA: 85.22 NumAromaticRings: 1

Sugarmoiety
SD00017

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