Glycoside
GD065118
Name:
NoneFormula:
C15H21O7N3Smiles:
O=C(N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cnc(=O)n(C2CCC2)c1Aglycone:
NC(=O)c1cnc(=O)n(C2CCC2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -2.5 | Num_rotatable_bonds: | 4 |
| MolWt: | 355.35 | Num_heavy_atoms: | 25 |
| TPSA: | 154.14 | NumAromaticRings: | 1 |
Unique Aglycone
AD31316
Formula: C9H11O2N3
Smiles:
NC(=O)c1cnc(=O)n(C2CCC2)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.44 |
| AlogP: | 0.07 | Num_rotatable_bonds: | 2 |
| MolWt: | 193.21 | Num_heavy_atoms: | 14 |
| TPSA: | 77.98 | NumAromaticRings: | 1 |
