Glycoside
GD033922
Name:
NoneFormula:
C22H30O12Smiles:
O=C(O[C@@H]1C[C@](O)(CO)[C@@H]2[C@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)OCC[C@@H]12)c1ccc(O)cc1Aglycone:
O=C(OC1CC(O)(CO)C2C(O)OCCC12)c1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.68 |
| AlogP: | -2.16 | Num_rotatable_bonds: | 6 |
| MolWt: | 486.47 | Num_heavy_atoms: | 34 |
| TPSA: | 195.6 | NumAromaticRings: | 1 |
Unique Aglycone
AD21622
Formula: C16H20O7
Smiles:
O=C(OC1CC(O)(CO)C2C(O)OCCC12)c1ccc(O)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | 0.02 | Num_rotatable_bonds: | 3 |
| MolWt: | 324.33 | Num_heavy_atoms: | 23 |
| TPSA: | 116.45 | NumAromaticRings: | 1 |
