Glycoside
GD025111
Name:
DAUMONEFormula:
C13H24O6Smiles:
C[C@@H]1O[C@H](O[C@H](C)CCCCC(=O)O)[C@H](O)C[C@H]1OAglycone:
CC(O)CCCCC(=O)OSugarmoiety:
CC1OC(O)C(O)CC1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.92 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 7 |
| MolWt: | 276.33 | Num_heavy_atoms: | 19 |
| TPSA: | 96.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD16688
Formula: C7H14O3
Smiles:
CC(O)CCCCC(=O)O| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.86 |
| AlogP: | 1.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 146.19 | Num_heavy_atoms: | 10 |
| TPSA: | 57.53 | NumAromaticRings: | 0 |
