Glycoside
GD078630
Name:
NoneFormula:
C20H21O6N3Smiles:
OC[C@H]1O[C@H](O)[C@H](Nc2ccc(-c3nnc(-c4ccccc4)o3)cc2)[C@@H](O)[C@@H]1OAglycone:
Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.3 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 399.4 | Num_heavy_atoms: | 29 |
| TPSA: | 141.1 | NumAromaticRings: | 3 |
Unique Aglycone
AD36132
Formula: C14H11ON3
Smiles:
Nc1ccc(-c2nnc(-c3ccccc3)o2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 2 |
| MolWt: | 237.26 | Num_heavy_atoms: | 18 |
| TPSA: | 64.94 | NumAromaticRings: | 3 |
