Glycoside
GD046882
Name:
NoneFormula:
C11H17O7N3Smiles:
COc1nc(N[C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]2O)cc(=O)[nH]1Aglycone:
COc1nc(N)cc(=O)[nH]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.64 |
| AlogP: | -3.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 303.27 | Num_heavy_atoms: | 21 |
| TPSA: | 157.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD25424
Formula: C5H7O2N3
Smiles:
COc1nc(N)cc(=O)[nH]1| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.2 |
| AlogP: | -0.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 141.13 | Num_heavy_atoms: | 10 |
| TPSA: | 81.0 | NumAromaticRings: | 1 |
