Glycoside
GD043162
Name:
NoneFormula:
C9H13O7N3Smiles:
Cn1c(=O)[nH]c(=O)n([C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c1=OAglycone:
Cn1c(=O)[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -4.15 | Num_rotatable_bonds: | 2 |
| MolWt: | 275.22 | Num_heavy_atoms: | 19 |
| TPSA: | 146.78 | NumAromaticRings: | 1 |
Unique Aglycone
AD17398
Formula: C4H5O3N3
Smiles:
Cn1c(=O)[nH]c(=O)[nH]c1=O| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | -2.24 | Num_rotatable_bonds: | 0 |
| MolWt: | 143.1 | Num_heavy_atoms: | 10 |
| TPSA: | 87.72 | NumAromaticRings: | 1 |
