Glycoside
GD081911
Name:
NoneFormula:
C18H25O8N3Smiles:
Cn1cccc1C(=O)N[C@@H]1CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)[C@@H]2COC[C@H]12Aglycone:
Cn1cccc1C(=O)NC1CNC2COCC21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.61 |
| AlogP: | -3.38 | Num_rotatable_bonds: | 7 |
| MolWt: | 411.41 | Num_heavy_atoms: | 29 |
| TPSA: | 161.56 | NumAromaticRings: | 1 |
Unique Aglycone
AD36796
Formula: C12H17O2N3
Smiles:
Cn1cccc1C(=O)NC1CNC2COCC21| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 2 |
| MolWt: | 235.29 | Num_heavy_atoms: | 17 |
| TPSA: | 55.29 | NumAromaticRings: | 1 |
