Glycoside
GD035329
Name:
HaemodoroxychrysenoseFormula:
C26H22O9Smiles:
COc1cc2ccc(=O)c3cc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)c4c5ccccc5oc1c4c23Aglycone:
COc1cc2ccc(=O)c3cc(O)c4c5ccccc5oc1c4c23Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 6 |
| HBD: | 4 | FractionCSP3: | 0.27 |
| AlogP: | 1.88 | Num_rotatable_bonds: | 4 |
| MolWt: | 478.45 | Num_heavy_atoms: | 35 |
| TPSA: | 138.82 | NumAromaticRings: | 5 |
Unique Aglycone
AD22366
Formula: C20H12O4
Smiles:
COc1cc2ccc(=O)c3cc(O)c4c5ccccc5oc1c4c23| HBA: | 4 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.05 |
| AlogP: | 4.4 | Num_rotatable_bonds: | 1 |
| MolWt: | 316.31 | Num_heavy_atoms: | 24 |
| TPSA: | 59.67 | NumAromaticRings: | 5 |
