Glycoside
GD044689
Name:
SecuriterpenosideFormula:
C11H18O8Smiles:
C=C(CCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)OAglycone:
C=C(CCO)C(=O)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -2.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 278.26 | Num_heavy_atoms: | 19 |
| TPSA: | 136.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD09140
Formula: C5H8O3
Smiles:
C=C(CCO)C(=O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | 0.01 | Num_rotatable_bonds: | 3 |
| MolWt: | 116.12 | Num_heavy_atoms: | 8 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
