Glycoside
GD142429
Name:
NoneFormula:
C21H34O10Smiles:
CC(=CCC(COC1OC(CO)C(O)C(O)C1O)C(C)C(=O)O)CC1CC(C)C(=O)O1Aglycone:
CC(=CCC(CO)C(C)C(=O)O)CC1CC(C)C(=O)O1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.81 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 10 |
| MolWt: | 446.49 | Num_heavy_atoms: | 31 |
| TPSA: | 162.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD57316
Formula: C15H24O5
Smiles:
CC(=CCC(CO)C(C)C(=O)O)CC1CC(C)C(=O)O1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.73 |
| AlogP: | 1.99 | Num_rotatable_bonds: | 7 |
| MolWt: | 284.35 | Num_heavy_atoms: | 20 |
| TPSA: | 83.83 | NumAromaticRings: | 0 |
