Glycoside
GD033040
Name:
NoneFormula:
C36H30O16Smiles:
O=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1c1c(O[C@@]2(O)O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12Aglycone:
O=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12Sugarmoiety:
OCC1OC(O)(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 7 |
| HBD: | 10 | FractionCSP3: | 0.22 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 6 |
| MolWt: | 718.62 | Num_heavy_atoms: | 52 |
| TPSA: | 277.27 | NumAromaticRings: | 5 |
Unique Aglycone
AD21118
Formula: C30H20O10
Smiles:
O=C1c2c(O)cc(O)cc2OC(c2ccc(O)cc2)C1c1c(O)cc(O)c2c(=O)cc(-c3ccc(O)cc3)oc12| HBA: | 10 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.07 |
| AlogP: | 4.79 | Num_rotatable_bonds: | 3 |
| MolWt: | 540.48 | Num_heavy_atoms: | 40 |
| TPSA: | 177.89 | NumAromaticRings: | 5 |
