Glycoside
GD065680
Name:
NoneFormula:
C15H18O8N2Smiles:
COc1ccc2onc(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2c1Aglycone:
COc1ccc2onc(C(N)=O)c2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -1.63 | Num_rotatable_bonds: | 4 |
| MolWt: | 354.32 | Num_heavy_atoms: | 25 |
| TPSA: | 154.51 | NumAromaticRings: | 2 |
Unique Aglycone
AD31608
Formula: C9H8O3N2
Smiles:
COc1ccc2onc(C(N)=O)c2c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 0.94 | Num_rotatable_bonds: | 2 |
| MolWt: | 192.17 | Num_heavy_atoms: | 14 |
| TPSA: | 78.35 | NumAromaticRings: | 2 |
