Glycoside
...
GD002833

Name:
None

Formula:
C30H45O17N

Smiles:
CC(=O)N[C@@H]1[C@H](O)C[C@](O[C@H]2[C@H](O)[C@@H](O[C@@H]3CCO[C@H](COCc4ccccc4)[C@H]3O)O[C@@H](CO)[C@H]2O)(C(=O)O)O[C@H]1[C@H](O)[C@H](O)CO

Aglycone:
CC(=O)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CO.OC1CCOC(COCc2ccccc2)C1O

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

Other Identifiers

Properties
HBA: 18 RingCount: 4
HBD: 10 FractionCSP3: 0.73
AlogP: -4.29 Num_rotatable_bonds: 14
MolWt: 691.68 Num_heavy_atoms: 48
TPSA: 283.62 NumAromaticRings: 1

Unique Aglycone
AD00077
Formula: C11H19O9N

Smiles:
CC(=O)NC1C(O)CC(O)(C(=O)O)OC1C(O)C(O)CO
HBA: 10 RingCount: 1
HBD: 7 FractionCSP3: 0.82
AlogP: -3.87 Num_rotatable_bonds: 5
MolWt: 309.27 Num_heavy_atoms: 21
TPSA: 176.78 NumAromaticRings: 0
AD02656
Formula: C13H18O4

Smiles:
OC1CCOC(COCc2ccccc2)C1O
HBA: 4 RingCount: 2
HBD: 2 FractionCSP3: 0.54
AlogP: 0.71 Num_rotatable_bonds: 4
MolWt: 238.28 Num_heavy_atoms: 17
TPSA: 58.92 NumAromaticRings: 1

Sugarmoiety
SD00003

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