Glycoside
GD005632
Name:
2-(hydroxymethyl)-6-{[2-(hydroxymethyl)-5-{[2-(4-hydroxyphenyl)ethenyl]oxy}-3,9-dioxatricyclo[4.4.0.0²,â´]dec-7-en-10-yl]oxy}oxane-3,4,5-triolFormula:
C23H28O11Smiles:
OC[C@@H]1O[C@H](O[C@@H]2OC=C[C@@H]3[C@H](OC=Cc4ccc(O)cc4)[C@@H]4O[C@@]4(CO)[C@H]23)[C@H](O)[C@H](O)[C@H]1OAglycone:
OCC12OC1C(OC=Cc1ccc(O)cc1)C1C=COC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.57 |
| AlogP: | -1.19 | Num_rotatable_bonds: | 7 |
| MolWt: | 480.47 | Num_heavy_atoms: | 34 |
| TPSA: | 170.83 | NumAromaticRings: | 1 |
Unique Aglycone
AD04756
Formula: C17H18O6
Smiles:
OCC12OC1C(OC=Cc1ccc(O)cc1)C1C=COC(O)C12| HBA: | 6 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.41 |
| AlogP: | 0.99 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.33 | Num_heavy_atoms: | 23 |
| TPSA: | 91.68 | NumAromaticRings: | 1 |
