Glycoside
GD037277
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 2-(3,8-dimethyl-2-oxo-1,2,4,5,6,7,8,8a-octahydroazulen-5-yl)prop-2-enoateFormula:
C21H30O8Smiles:
C=C(C(=O)O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@@H]1CC[C@H](C)[C@@H]2CC(=O)C(C)=C2C1Aglycone:
C=C(C(=O)O)C1CCC(C)C2CC(=O)C(C)=C2C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | 0.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 410.46 | Num_heavy_atoms: | 29 |
| TPSA: | 133.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD23493
Formula: C15H20O3
Smiles:
C=C(C(=O)O)C1CCC(C)C2CC(=O)C(C)=C2C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 2.97 | Num_rotatable_bonds: | 2 |
| MolWt: | 248.32 | Num_heavy_atoms: | 18 |
| TPSA: | 54.37 | NumAromaticRings: | 0 |
