Glycoside
GD086049
Name:
NoneFormula:
C23H34O7Smiles:
Cc1cccc2c1OC[C@@H]1C(C)(C)[C@@H](O[C@@H]3O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]3O)CC[C@]21CAglycone:
Cc1cccc2c1OCC1C2(C)CCC(O)C1(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.74 |
| AlogP: | 1.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 422.52 | Num_heavy_atoms: | 30 |
| TPSA: | 108.61 | NumAromaticRings: | 1 |
Unique Aglycone
AD38251
Formula: C17H24O2
Smiles:
Cc1cccc2c1OCC1C2(C)CCC(O)C1(C)C| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.65 |
| AlogP: | 3.44 | Num_rotatable_bonds: | 0 |
| MolWt: | 260.38 | Num_heavy_atoms: | 19 |
| TPSA: | 29.46 | NumAromaticRings: | 1 |
