Glycoside
GD081323
Name:
NoneFormula:
C18H23O8N2FSmiles:
O=C(C(=O)N1C[C@@H]2COC[C@]2(COc2ncccc2F)C1)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
Fc1cccnc1OCC12CNCC1COC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.61 |
| AlogP: | -2.28 | Num_rotatable_bonds: | 8 |
| MolWt: | 414.39 | Num_heavy_atoms: | 29 |
| TPSA: | 149.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD36649
Formula: C12H15O2N2F
Smiles:
Fc1cccnc1OCC12CNCC1COC2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.58 |
| AlogP: | 0.84 | Num_rotatable_bonds: | 3 |
| MolWt: | 238.26 | Num_heavy_atoms: | 17 |
| TPSA: | 43.38 | NumAromaticRings: | 1 |
