Glycoside
...
GD092488

Name:
None

Formula:
C21H23O10N

Smiles:
CO[C@@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1N1C(=O)c2ccccc2C1=O

Aglycone:
COC(C)=O.O=C1NC(=O)c2ccccc21

Sugarmoiety:
COC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O

Other Identifiers

Properties
HBA: 11 RingCount: 3
HBD: 0 FractionCSP3: 0.48
AlogP: 0.45 Num_rotatable_bonds: 6
MolWt: 449.41 Num_heavy_atoms: 32
TPSA: 134.74 NumAromaticRings: 1

Unique Aglycone
AD00017
Formula: C3H6O2

Smiles:
COC(C)=O
HBA: 2 RingCount: 0
HBD: 0 FractionCSP3: 0.67
AlogP: 0.18 Num_rotatable_bonds: 0
MolWt: 74.08 Num_heavy_atoms: 5
TPSA: 26.3 NumAromaticRings: 0
AD03368
Formula: C8H5O2N

Smiles:
O=C1NC(=O)c2ccccc21
HBA: 3 RingCount: 2
HBD: 1 FractionCSP3: 0.0
AlogP: 0.57 Num_rotatable_bonds: 0
MolWt: 147.13 Num_heavy_atoms: 11
TPSA: 46.17 NumAromaticRings: 1

Sugarmoiety
SD00410

COC1OC(O)C(OC(C)=O)C(OC(C)=O)C1O