Glycoside
GD015311
Name:
NoneFormula:
C21H34O6Smiles:
CCCCc1ccc(CCCCCO[C@@H]2[C@H](O)C(O)O[C@H](CO)[C@H]2O)cc1Aglycone:
CCCCc1ccc(CCCCCO)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | 1.56 | Num_rotatable_bonds: | 11 |
| MolWt: | 382.5 | Num_heavy_atoms: | 27 |
| TPSA: | 99.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD11141
Formula: C15H24O
Smiles:
CCCCc1ccc(CCCCCO)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 3.73 | Num_rotatable_bonds: | 8 |
| MolWt: | 220.36 | Num_heavy_atoms: | 16 |
| TPSA: | 20.23 | NumAromaticRings: | 1 |
