Glycoside
GD033629
Name:
NoneFormula:
C21H26O10Smiles:
Cc1cc2c(c(C)c1CC(=O)O[C@@H]1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)C(=O)[C@](C)(CO)C2Aglycone:
Cc1cc2c(c(C)c1CC(=O)O)C(=O)C(C)(CO)C2Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.57 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 5 |
| MolWt: | 438.43 | Num_heavy_atoms: | 31 |
| TPSA: | 170.82 | NumAromaticRings: | 1 |
Unique Aglycone
AD21451
Formula: C15H18O4
Smiles:
Cc1cc2c(c(C)c1CC(=O)O)C(=O)C(C)(CO)C2| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.47 |
| AlogP: | 1.67 | Num_rotatable_bonds: | 3 |
| MolWt: | 262.31 | Num_heavy_atoms: | 19 |
| TPSA: | 74.6 | NumAromaticRings: | 1 |
