Glycoside
GD087842
Name:
NoneFormula:
C19H27O8N3Smiles:
COC(=O)C1CCN(C(=O)c2cccnc2N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC1Aglycone:
COC(=O)C1CCN(C(=O)c2cccnc2N)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.63 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 425.44 | Num_heavy_atoms: | 30 |
| TPSA: | 161.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD38522
Formula: C13H17O3N3
Smiles:
COC(=O)C1CCN(C(=O)c2cccnc2N)CC1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.46 |
| AlogP: | 0.69 | Num_rotatable_bonds: | 2 |
| MolWt: | 263.3 | Num_heavy_atoms: | 19 |
| TPSA: | 85.52 | NumAromaticRings: | 1 |
