Glycoside
GD058997
Name:
NoneFormula:
C17H20O6N2Smiles:
CC(=O)N[C@H]1[C@H](Oc2cccc3cccnc23)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Oc1cccc2cccnc12Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.41 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 4 |
| MolWt: | 348.36 | Num_heavy_atoms: | 25 |
| TPSA: | 121.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD15598
Formula: C9H7ON
Smiles:
Oc1cccc2cccnc12| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 1.94 | Num_rotatable_bonds: | 0 |
| MolWt: | 145.16 | Num_heavy_atoms: | 11 |
| TPSA: | 33.12 | NumAromaticRings: | 2 |
