Glycoside
GD026939
Name:
NoneFormula:
C29H36O14Smiles:
COc1cc([C@@H]2OC[C@@H]3[C@H](c4cc(OC)c(OC)c(OC)c4O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)OC[C@H]23)cc2c1OCO2Aglycone:
COc1cc(C2OCC3C(c4cc(OC)c(OC)c(OC)c4O)OCC23)cc2c1OCO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.59 |
| AlogP: | 0.7 | Num_rotatable_bonds: | 9 |
| MolWt: | 608.59 | Num_heavy_atoms: | 43 |
| TPSA: | 173.22 | NumAromaticRings: | 2 |
Unique Aglycone
AD17732
Formula: C23H26O9
Smiles:
COc1cc(C2OCC3C(c4cc(OC)c(OC)c(OC)c4O)OCC23)cc2c1OCO2| HBA: | 9 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.48 |
| AlogP: | 3.23 | Num_rotatable_bonds: | 6 |
| MolWt: | 446.45 | Num_heavy_atoms: | 32 |
| TPSA: | 94.07 | NumAromaticRings: | 2 |
