Glycoside
GD036889
Name:
NoneFormula:
C30H40O13Smiles:
CCCCOc1cc(C=Cc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
CCCCOc1cc(O)cc(C=Cc2ccc(O)cc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.53 |
| AlogP: | -0.61 | Num_rotatable_bonds: | 12 |
| MolWt: | 608.64 | Num_heavy_atoms: | 43 |
| TPSA: | 207.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD23257
Formula: C18H20O3
Smiles:
CCCCOc1cc(O)cc(C=Cc2ccc(O)cc2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 4.45 | Num_rotatable_bonds: | 6 |
| MolWt: | 284.36 | Num_heavy_atoms: | 21 |
| TPSA: | 49.69 | NumAromaticRings: | 2 |
