Glycoside
...
GD105276

Name:
None

Formula:
C26H23O7N

Smiles:
CCc1ccc(NC(=O)[C@@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)C(=O)O)cc1

Aglycone:
CCc1ccc(N)cc1.O=Cc1ccccc1.O=Cc1ccccc1

Sugarmoiety:
O=C(O)C(OO)C(OO)C(=O)O

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 2 FractionCSP3: 0.15
AlogP: 3.72 Num_rotatable_bonds: 9
MolWt: 461.47 Num_heavy_atoms: 34
TPSA: 119.0 NumAromaticRings: 3

Unique Aglycone
AD01696
Formula: C7H6O

Smiles:
O=Cc1ccccc1
HBA: 1 RingCount: 1
HBD: 0 FractionCSP3: 0.0
AlogP: 1.5 Num_rotatable_bonds: 1
MolWt: 106.12 Num_heavy_atoms: 8
TPSA: 17.07 NumAromaticRings: 1
AD44046
Formula: C8H11N

Smiles:
CCc1ccc(N)cc1
HBA: 1 RingCount: 1
HBD: 2 FractionCSP3: 0.25
AlogP: 1.83 Num_rotatable_bonds: 1
MolWt: 121.18 Num_heavy_atoms: 9
TPSA: 26.02 NumAromaticRings: 1

Sugarmoiety
SD00296

O=C(O)C(OO)C(OO)C(=O)O