Glycoside
...
GD024603

Name:
None

Formula:
C29H29O4N2Cl

Smiles:
O=C(NCc1ccc(Cc2ccccc2)cc1)[C@H](O)[C@H](O)C(=O)N1CCCC1c1cccc(Cl)c1

Aglycone:
Clc1cccc(C2CCCN2)c1.NCc1ccc(Cc2ccccc2)cc1

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

Other Identifiers

Properties
HBA: 6 RingCount: 4
HBD: 3 FractionCSP3: 0.29
AlogP: 3.63 Num_rotatable_bonds: 8
MolWt: 493.0 Num_heavy_atoms: 35
TPSA: 89.87 NumAromaticRings: 3

Unique Aglycone
AD04593
Formula: C11H12NCl

Smiles:
Clc1cccc(C2CCCN2)c1
HBA: 1 RingCount: 2
HBD: 1 FractionCSP3: 0.4
AlogP: 2.76 Num_rotatable_bonds: 1
MolWt: 181.67 Num_heavy_atoms: 12
TPSA: 12.03 NumAromaticRings: 1
AD16398
Formula: C14H15N

Smiles:
NCc1ccc(Cc2ccccc2)cc1
HBA: 1 RingCount: 2
HBD: 2 FractionCSP3: 0.14
AlogP: 2.74 Num_rotatable_bonds: 3
MolWt: 197.28 Num_heavy_atoms: 15
TPSA: 26.02 NumAromaticRings: 2

Sugarmoiety
SD00169

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