Glycoside
...
GD078583

Name:
None

Formula:
C19H22O5N3Cl

Smiles:
Cc1c(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nnc(-c2ccc(Cl)cc2)c1C

Aglycone:
Cc1c(N)nnc(-c2ccc(Cl)cc2)c1C

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

Other Identifiers

Properties
HBA: 8 RingCount: 3
HBD: 5 FractionCSP3: 0.44
AlogP: 0.63 Num_rotatable_bonds: 4
MolWt: 395.84 Num_heavy_atoms: 27
TPSA: 127.96 NumAromaticRings: 2

Unique Aglycone
AD36109
Formula: C13H12N3Cl

Smiles:
Cc1c(N)nnc(-c2ccc(Cl)cc2)c1C
HBA: 3 RingCount: 2
HBD: 2 FractionCSP3: 0.17
AlogP: 3.0 Num_rotatable_bonds: 1
MolWt: 233.7 Num_heavy_atoms: 16
TPSA: 51.8 NumAromaticRings: 2

Sugarmoiety
SD00003

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