Glycoside
GD017463
Name:
NoneFormula:
C16H21O9NSmiles:
COc1cc(C(=O)N[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc2c1OCCO2Aglycone:
COc1cc(C(N)=O)cc2c1OCCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -2.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 371.34 | Num_heavy_atoms: | 26 |
| TPSA: | 146.94 | NumAromaticRings: | 1 |
Unique Aglycone
AD12456
Formula: C10H11O4N
Smiles:
COc1cc(C(N)=O)cc2c1OCCO2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 0.57 | Num_rotatable_bonds: | 2 |
| MolWt: | 209.2 | Num_heavy_atoms: | 15 |
| TPSA: | 70.78 | NumAromaticRings: | 1 |
