Glycoside
...
GD104942

Name:
None

Formula:
C26H21O9N

Smiles:
COC(=O)c1ccccc1NC(=O)[C@H](OC(=O)c1ccccc1)[C@@H](OC(=O)c1ccccc1)C(=O)O

Aglycone:
COC(=O)c1ccccc1N.O=Cc1ccccc1.O=Cc1ccccc1

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

Other Identifiers

Properties
HBA: 10 RingCount: 3
HBD: 2 FractionCSP3: 0.12
AlogP: 2.95 Num_rotatable_bonds: 9
MolWt: 491.45 Num_heavy_atoms: 36
TPSA: 145.3 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
AD25269
Formula: C8H9O2N

Smiles:
COC(=O)c1ccccc1N
HBA: 3 RingCount: 1
HBD: 2 FractionCSP3: 0.12
AlogP: 1.06 Num_rotatable_bonds: 1
MolWt: 151.16 Num_heavy_atoms: 11
TPSA: 52.32 NumAromaticRings: 1

Sugarmoiety
SD00296

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