Glycoside
GD044663
Name:
NoneFormula:
C13H21O4N4Smiles:
CN([NH2+]/C=C(\NN)[C@@H](O)C(=O)[C@H](O)CO)c1ccccc1Aglycone:
CN([NH2+]C=CNN)c1ccccc1Sugarmoiety:
O=C(C(O)O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 8 | FractionCSP3: | 0.31 |
| AlogP: | -2.81 | Num_rotatable_bonds: | 8 |
| MolWt: | 297.34 | Num_heavy_atoms: | 21 |
| TPSA: | 135.66 | NumAromaticRings: | 1 |
Unique Aglycone
AD25070
Formula: C9H15N4
Smiles:
CN([NH2+]C=CNN)c1ccccc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.11 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 179.25 | Num_heavy_atoms: | 13 |
| TPSA: | 57.9 | NumAromaticRings: | 1 |
