Glycoside
GD031221
Name:
NoneFormula:
C34H34O10Smiles:
COc1cc(OCc2ccccc2)c(C(=O)c2ccc(OCc3ccccc3)cc2)c(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
COc1cc(O)c(C(=O)c2ccc(OCc3ccccc3)cc2)c(OCc2ccccc2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.26 |
| AlogP: | 3.26 | Num_rotatable_bonds: | 12 |
| MolWt: | 602.64 | Num_heavy_atoms: | 44 |
| TPSA: | 144.14 | NumAromaticRings: | 4 |
Unique Aglycone
AD20128
Formula: C28H24O5
Smiles:
COc1cc(O)c(C(=O)c2ccc(OCc3ccccc3)cc2)c(OCc2ccccc2)c1| HBA: | 5 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 5.79 | Num_rotatable_bonds: | 9 |
| MolWt: | 440.5 | Num_heavy_atoms: | 33 |
| TPSA: | 64.99 | NumAromaticRings: | 4 |
