Glycoside
GD006707
Name:
NoneFormula:
C29H36O15Smiles:
COc1c(O)cc([C@@H]2OC[C@@H]3[C@H](c4cc5c(c(OC)c4OC)OCO5)OC[C@H]23)c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1OCAglycone:
COc1c(O)cc(C2OCC3C(c4cc5c(c(OC)c4OC)OCO5)OCC23)c(O)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 6 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 9 |
| MolWt: | 624.59 | Num_heavy_atoms: | 44 |
| TPSA: | 193.45 | NumAromaticRings: | 2 |
Unique Aglycone
AD05519
Formula: C23H26O10
Smiles:
COc1c(O)cc(C2OCC3C(c4cc5c(c(OC)c4OC)OCO5)OCC23)c(O)c1OC| HBA: | 10 | RingCount: | 5 |
| HBD: | 2 | FractionCSP3: | 0.48 |
| AlogP: | 2.94 | Num_rotatable_bonds: | 6 |
| MolWt: | 462.45 | Num_heavy_atoms: | 33 |
| TPSA: | 114.3 | NumAromaticRings: | 2 |
