Glycoside
GD008902
Name:
NoneFormula:
C18H25O5N2ClSSmiles:
CCc1ccc(C(=O)NC(C(C)Cl)C2OC(SC)C(O)C(O)C2O)nc1Aglycone:
CCc1ccc(C(=O)NCC(C)Cl)nc1Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | 0.54 | Num_rotatable_bonds: | 6 |
| MolWt: | 404.92 | Num_heavy_atoms: | 26 |
| TPSA: | 111.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD07049
Formula: C12H15ON2Cl
Smiles:
CCc1ccc(C(=O)NCC(C)Cl)nc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 4 |
| MolWt: | 226.71 | Num_heavy_atoms: | 15 |
| TPSA: | 41.99 | NumAromaticRings: | 1 |
