Glycoside
...
GD146985

Name:
21-24

Formula:
C26H20O5N2Cl2

Smiles:
OCC1OC(n2c3ccc(Cl)cc3c3ccc4c5cc(Cl)ccc5[nH]c4c32)C(O)C(O)C1O

Aglycone:
Clc1ccc2[nH]c3c(ccc4c5cc(Cl)ccc5[nH]c43)c2c1

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

Other Identifiers

Properties
HBA: 7 RingCount: 6
HBD: 5 FractionCSP3: 0.25
AlogP: 3.71 Num_rotatable_bonds: 2
MolWt: 487.34 Num_heavy_atoms: 33
TPSA: 110.87 NumAromaticRings: 5

Unique Aglycone
AD48960
Formula: C20H10N2Cl2

Smiles:
Clc1ccc2[nH]c3c(ccc4c5cc(Cl)ccc5[nH]c43)c2c1
HBA: 2 RingCount: 5
HBD: 2 FractionCSP3: 0.0
AlogP: 6.26 Num_rotatable_bonds: 0
MolWt: 325.2 Num_heavy_atoms: 22
TPSA: 31.58 NumAromaticRings: 5

Sugarmoiety
SD00003

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