Glycoside
GD005170
Name:
NoneFormula:
C18H20O7N4Smiles:
CO[C@@H]1O[C@H](Cn2cc(CN3C(=O)c4ccccc4C3=O)nn2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Cn1cc(CN2C(=O)c3ccccc3C2=O)nn1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.44 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 404.38 | Num_heavy_atoms: | 29 |
| TPSA: | 147.24 | NumAromaticRings: | 2 |
Unique Aglycone
AD04416
Formula: C12H10O2N4
Smiles:
Cn1cc(CN2C(=O)c3ccccc3C2=O)nn1| HBA: | 6 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.17 |
| AlogP: | 0.61 | Num_rotatable_bonds: | 2 |
| MolWt: | 242.24 | Num_heavy_atoms: | 18 |
| TPSA: | 68.09 | NumAromaticRings: | 2 |
