Glycoside
GD014588
Name:
NoneFormula:
C25H24O6N2Smiles:
OC[C@@H]1O[C@H](Oc2ccc(Nc3c4ccccc4nc4ccccc34)cc2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1ccc(Nc2c3ccccc3nc3ccccc23)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.24 |
| AlogP: | 2.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 448.48 | Num_heavy_atoms: | 33 |
| TPSA: | 124.3 | NumAromaticRings: | 4 |
Unique Aglycone
AD10705
Formula: C19H14ON2
Smiles:
Oc1ccc(Nc2c3ccccc3nc3ccccc23)cc1| HBA: | 3 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 4.84 | Num_rotatable_bonds: | 2 |
| MolWt: | 286.33 | Num_heavy_atoms: | 22 |
| TPSA: | 45.15 | NumAromaticRings: | 4 |
