Glycoside
GD062817
Name:
NoneFormula:
C13H17O9N3Smiles:
CCOC(=O)NC(=O)c1cn([C@@H]2O[C@@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=OAglycone:
CCOC(=O)NC(=O)c1c[nH]c(=O)[nH]c1=OSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.54 |
| AlogP: | -2.97 | Num_rotatable_bonds: | 4 |
| MolWt: | 359.29 | Num_heavy_atoms: | 25 |
| TPSA: | 180.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD13721
Formula: C8H9O5N3
Smiles:
CCOC(=O)NC(=O)c1c[nH]c(=O)[nH]c1=O| HBA: | 8 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.25 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 2 |
| MolWt: | 227.18 | Num_heavy_atoms: | 16 |
| TPSA: | 121.12 | NumAromaticRings: | 1 |
