Glycoside
GD005477
Name:
NoneFormula:
C12H17O6N3Smiles:
CCOc1cc(-c2nc([C@H](O)[C@H](O)[C@H](O)CO)c[nH]2)no1Aglycone:
CCOc1cc(-c2ncc[nH]2)no1Sugarmoiety:
OCC(O)C(O)C(O)OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 7 |
| MolWt: | 299.28 | Num_heavy_atoms: | 21 |
| TPSA: | 144.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD04654
Formula: C8H9O2N3
Smiles:
CCOc1cc(-c2ncc[nH]2)no1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 179.18 | Num_heavy_atoms: | 13 |
| TPSA: | 63.94 | NumAromaticRings: | 2 |
