Glycoside
GD006601
Name:
NoneFormula:
C23H29O6N2ClSmiles:
CCCCCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)nn1Aglycone:
CCCCCOc1ccc(Cc2ccccc2Cl)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 9 |
| MolWt: | 452.94 | Num_heavy_atoms: | 31 |
| TPSA: | 125.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD05451
Formula: C17H19ON2Cl
Smiles:
CCCCCOc1ccc(Cc2ccccc2Cl)nn1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.38 |
| AlogP: | 4.29 | Num_rotatable_bonds: | 7 |
| MolWt: | 290.79 | Num_heavy_atoms: | 20 |
| TPSA: | 35.01 | NumAromaticRings: | 2 |
