Glycoside
GD013811
Name:
NoneFormula:
C20H35O5N2ClSSmiles:
CSC1OC(C(NC(=O)[C@@H]2C[C@H](C(C)(C)C)CCN2)C(C)Cl)C(O)C(O)C1OAglycone:
CC(Cl)CNC(=O)C1CC(C(C)(C)C)CCN1Sugarmoiety:
CSC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.95 |
| AlogP: | 0.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 439.02 | Num_heavy_atoms: | 28 |
| TPSA: | 111.05 | NumAromaticRings: | 0 |
Unique Aglycone
AD10246
Formula: C14H25ON2Cl
Smiles:
CC(Cl)CNC(=O)C1CC(C(C)(C)C)CCN1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.92 |
| AlogP: | 2.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 260.81 | Num_heavy_atoms: | 17 |
| TPSA: | 41.13 | NumAromaticRings: | 0 |
