Glycoside
GD074957
Name:
NoneFormula:
C18H20O7N2Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1ccc(=O)n(-c2ccccc2)c1Aglycone:
NC(=O)c1ccc(=O)n(-c2ccccc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 376.37 | Num_heavy_atoms: | 27 |
| TPSA: | 141.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD34678
Formula: C12H10O2N2
Smiles:
NC(=O)c1ccc(=O)n(-c2ccccc2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.94 | Num_rotatable_bonds: | 2 |
| MolWt: | 214.22 | Num_heavy_atoms: | 16 |
| TPSA: | 65.09 | NumAromaticRings: | 2 |
