Glycoside
GD099067
Name:
NoneFormula:
C20H20O12Smiles:
COc1c(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)cc(=O)c2c(O)c3c(O)ccc(O)c3oc1-2Aglycone:
COc1c(O)cc(=O)c2c(O)c3c(O)ccc(O)c3oc1-2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.35 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 452.37 | Num_heavy_atoms: | 32 |
| TPSA: | 199.51 | NumAromaticRings: | 1 |
Unique Aglycone
AD42173
Formula: C14H10O7
Smiles:
COc1c(O)cc(=O)c2c(O)c3c(O)ccc(O)c3oc1-2| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 1 |
| MolWt: | 290.23 | Num_heavy_atoms: | 21 |
| TPSA: | 120.36 | NumAromaticRings: | 1 |
