Glycoside
GD044382
Name:
NoneFormula:
C12H17O6N3Smiles:
O=C(C(=O)N1CCc2nc[nH]c2C1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1nc2c([nH]1)CNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -3.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 299.28 | Num_heavy_atoms: | 21 |
| TPSA: | 146.98 | NumAromaticRings: | 1 |
Unique Aglycone
AD25003
Formula: C6H9N3
Smiles:
c1nc2c([nH]1)CNCC2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 0 |
| MolWt: | 123.16 | Num_heavy_atoms: | 9 |
| TPSA: | 40.71 | NumAromaticRings: | 1 |
