Glycoside
GD024522
Name:
NoneFormula:
C20H25O4N3Smiles:
COC[C@H](O)[C@H](OC)[C@H](OC)c1cnc2cc(-c3ccc(C)cc3)nn2c1Aglycone:
Cc1ccc(-c2cc3ncccn3n2)cc1Sugarmoiety:
COCC(O)C(OC)C(O)OCOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 2.41 | Num_rotatable_bonds: | 8 |
| MolWt: | 371.44 | Num_heavy_atoms: | 27 |
| TPSA: | 78.11 | NumAromaticRings: | 3 |
Unique Aglycone
AD16353
Formula: C13H11N3
Smiles:
Cc1ccc(-c2cc3ncccn3n2)cc1| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.08 |
| AlogP: | 2.7 | Num_rotatable_bonds: | 1 |
| MolWt: | 209.25 | Num_heavy_atoms: | 16 |
| TPSA: | 30.19 | NumAromaticRings: | 3 |
