Glycoside
GD025168
Name:
NoneFormula:
C27H34O13Smiles:
CC=C1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C(C(=O)OC)[C@H]1CC(=O)OCCc1ccc2c(c1)OCCO2Aglycone:
CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OCCc1ccc2c(c1)OCCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 9 |
| MolWt: | 566.56 | Num_heavy_atoms: | 40 |
| TPSA: | 179.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD16718
Formula: C21H24O8
Smiles:
CC=C1C(O)OC=C(C(=O)OC)C1CC(=O)OCCc1ccc2c(c1)OCCO2| HBA: | 8 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.43 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 6 |
| MolWt: | 404.42 | Num_heavy_atoms: | 29 |
| TPSA: | 100.52 | NumAromaticRings: | 1 |
