Glycoside
GD013365
Name:
NoneFormula:
C30H36O14Smiles:
C=CCc1ccc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(-c2cc(C(O)C=C)ccc2O[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
C=CCc1ccc(O)c(-c2cc(C(O)C=C)ccc2O)c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.43 |
| AlogP: | -1.25 | Num_rotatable_bonds: | 11 |
| MolWt: | 620.6 | Num_heavy_atoms: | 44 |
| TPSA: | 236.06 | NumAromaticRings: | 2 |
Unique Aglycone
AD09982
Formula: C18H18O3
Smiles:
C=CCc1ccc(O)c(-c2cc(C(O)C=C)ccc2O)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.11 |
| AlogP: | 3.71 | Num_rotatable_bonds: | 5 |
| MolWt: | 282.34 | Num_heavy_atoms: | 21 |
| TPSA: | 60.69 | NumAromaticRings: | 2 |
