Glycoside
GD022169
Name:
NoneFormula:
C21H22O6NClSmiles:
OC[C@@H]1O[C@H](Oc2ccc(N3CCc4ccccc43)cc2Cl)[C@H](O)[C@H](O)[C@H]1OAglycone:
Oc1ccc(N2CCc3ccccc32)cc1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 4 |
| MolWt: | 407.85 | Num_heavy_atoms: | 28 |
| TPSA: | 102.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD15066
Formula: C15H12ONCl
Smiles:
Oc1ccc(N2CCc3ccccc32)cc1Cl| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.14 |
| AlogP: | 3.74 | Num_rotatable_bonds: | 1 |
| MolWt: | 245.71 | Num_heavy_atoms: | 17 |
| TPSA: | 23.47 | NumAromaticRings: | 2 |
