Glycoside
GD035623
Name:
NoneFormula:
C32H42O17Smiles:
COc1cc(C)c(C(=O)OC[C@@H]2O[C@H](O[C@@H]3O[C@H](COC(=O)c4c(C)cc(OC)cc4OC)[C@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](O)[C@H]2O)c(OC)c1Aglycone:
COC(=O)c1c(C)cc(OC)cc1OC.COC(=O)c1c(C)cc(OC)cc1OCSugarmoiety:
OC1OC(OC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 17 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 12 |
| MolWt: | 698.67 | Num_heavy_atoms: | 49 |
| TPSA: | 238.59 | NumAromaticRings: | 2 |
Unique Aglycone
AD22529
Formula: C11H14O4
Smiles:
COC(=O)c1c(C)cc(OC)cc1OC| HBA: | 4 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.36 |
| AlogP: | 1.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 210.23 | Num_heavy_atoms: | 15 |
| TPSA: | 44.76 | NumAromaticRings: | 1 |
