Glycoside
GD047821
Name:
NoneFormula:
C12H17O7N3Smiles:
COC(=O)c1cnnc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
COC(=O)c1cnnc(N)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -2.52 | Num_rotatable_bonds: | 4 |
| MolWt: | 315.28 | Num_heavy_atoms: | 22 |
| TPSA: | 154.26 | NumAromaticRings: | 1 |
Unique Aglycone
AD25684
Formula: C6H7O2N3
Smiles:
COC(=O)c1cnnc(N)c1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 153.14 | Num_heavy_atoms: | 11 |
| TPSA: | 78.1 | NumAromaticRings: | 1 |
