Glycoside
GD081450
Name:
NoneFormula:
C19H25O7N3Smiles:
O=C(NCc1cccnc1)[C@H]1C[C@]12CCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)C2Aglycone:
O=C(NCc1cccnc1)C1CC12CCNC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -2.42 | Num_rotatable_bonds: | 8 |
| MolWt: | 407.42 | Num_heavy_atoms: | 29 |
| TPSA: | 160.29 | NumAromaticRings: | 1 |
Unique Aglycone
AD36680
Formula: C13H17ON3
Smiles:
O=C(NCc1cccnc1)C1CC12CCNC2| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 0.7 | Num_rotatable_bonds: | 3 |
| MolWt: | 231.3 | Num_heavy_atoms: | 17 |
| TPSA: | 54.02 | NumAromaticRings: | 1 |
