Glycoside
GD059991
Name:
NoneFormula:
C17H20O6N2Smiles:
Cc1cc(C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c2ncccc2c1Aglycone:
Cc1cc(C(N)=O)c2ncccc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -0.93 | Num_rotatable_bonds: | 3 |
| MolWt: | 348.36 | Num_heavy_atoms: | 25 |
| TPSA: | 132.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD29647
Formula: C11H10ON2
Smiles:
Cc1cc(C(N)=O)c2ncccc2c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 1.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 186.21 | Num_heavy_atoms: | 14 |
| TPSA: | 55.98 | NumAromaticRings: | 2 |
