Glycoside
GD017875
Name:
NoneFormula:
C28H48O12Smiles:
CCCCCCCCCCCCCCCC(=O)OC[C@H](O)[C@@H]1OC(=O)C(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)=C1OAglycone:
CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(=O)C(O)=C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.86 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 20 |
| MolWt: | 576.68 | Num_heavy_atoms: | 40 |
| TPSA: | 192.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD12705
Formula: C22H38O7
Smiles:
CCCCCCCCCCCCCCCC(=O)OCC(O)C1OC(=O)C(O)=C1O| HBA: | 7 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.82 |
| AlogP: | 4.62 | Num_rotatable_bonds: | 17 |
| MolWt: | 414.54 | Num_heavy_atoms: | 29 |
| TPSA: | 113.29 | NumAromaticRings: | 0 |
