Glycoside
GD032055
Name:
TRIPHYLLIN AFormula:
C30H40O16Smiles:
COc1ccc([C@@H]2C[C@H](O)c3c(c(C)c(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)c(CO)c3O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)O2)cc1Aglycone:
COc1ccc(C2CC(O)c3c(O)c(CO)c(O)c(C)c3O2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 5 |
| HBD: | 10 | FractionCSP3: | 0.6 |
| AlogP: | -2.59 | Num_rotatable_bonds: | 9 |
| MolWt: | 656.63 | Num_heavy_atoms: | 46 |
| TPSA: | 257.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD20588
Formula: C18H20O6
Smiles:
COc1ccc(C2CC(O)c3c(O)c(CO)c(O)c(C)c3O2)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 2.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.35 | Num_heavy_atoms: | 24 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
