Glycoside
GD025786
Name:
NoneFormula:
C23H26O6NClSSmiles:
COC1O[C@H](c2ccc(Cl)c(Cc3ccc(OC(=S)N(C)C)cc3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
CN(C)C(=S)Oc1ccc(Cc2ccccc2Cl)cc1Sugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.41 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 467.97 | Num_heavy_atoms: | 31 |
| TPSA: | 91.62 | NumAromaticRings: | 2 |
Unique Aglycone
AD17062
Formula: C17H16ONClS
Smiles:
CN(C)C(=S)Oc1ccc(Cc2ccccc2Cl)cc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.19 |
| AlogP: | 4.16 | Num_rotatable_bonds: | 3 |
| MolWt: | 305.83 | Num_heavy_atoms: | 20 |
| TPSA: | 12.47 | NumAromaticRings: | 2 |
