Glycoside
...
GD098202

Name:
None

Formula:
C24H29O6N4Cl

Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)[C@H](c1cccnc1)N1CCN(c2ccc(Cl)cc2)CC1

Aglycone:
NC(=O)C(c1cccnc1)N1CCN(c2ccc(Cl)cc2)CC1

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

Other Identifiers

Properties
HBA: 10 RingCount: 4
HBD: 5 FractionCSP3: 0.48
AlogP: -0.49 Num_rotatable_bonds: 6
MolWt: 492.96 Num_heavy_atoms: 34
TPSA: 138.62 NumAromaticRings: 2

Unique Aglycone
AD41784
Formula: C18H19ON4Cl

Smiles:
NC(=O)C(c1cccnc1)N1CCN(c2ccc(Cl)cc2)CC1
HBA: 5 RingCount: 3
HBD: 2 FractionCSP3: 0.29
AlogP: 2.08 Num_rotatable_bonds: 4
MolWt: 330.82 Num_heavy_atoms: 23
TPSA: 62.46 NumAromaticRings: 2

Sugarmoiety
SD00003

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