Glycoside
GD005947
Name:
NoneFormula:
C21H42O5Smiles:
CCCCOC[C@@H]1O[C@H](CCC)[C@H](O)[C@H](OCCCC)C1OCCCCAglycone:
CCCCO.CCCCO.CCCCOCSugarmoiety:
CCCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 4.1 | Num_rotatable_bonds: | 15 |
| MolWt: | 374.56 | Num_heavy_atoms: | 26 |
| TPSA: | 57.15 | NumAromaticRings: | 0 |
Unique Aglycone
AD00936
Formula: C4H10O
Smiles:
CCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 2 |
| MolWt: | 74.12 | Num_heavy_atoms: | 5 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
AD03703
Formula: C5H12O
Smiles:
CCCCOC| HBA: | 1 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 1.0 |
| AlogP: | 1.43 | Num_rotatable_bonds: | 3 |
| MolWt: | 88.15 | Num_heavy_atoms: | 6 |
| TPSA: | 9.23 | NumAromaticRings: | 0 |
