Glycoside
GD122722
Name:
3-hydroxy-1,9-bis(4-hydroxyphenyl)-7-[(3,4,5-trihydroxyoxan-2-yl)oxy]nonan-5-oneFormula:
C26H34O9Smiles:
O=C(CC(O)CCc1ccc(O)cc1)CC(CCc1ccc(O)cc1)OC1OCC(O)C(O)C1OAglycone:
O=C(CC(O)CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | 1.2 | Num_rotatable_bonds: | 12 |
| MolWt: | 490.55 | Num_heavy_atoms: | 35 |
| TPSA: | 156.91 | NumAromaticRings: | 2 |
Unique Aglycone
AD46365
Formula: C21H26O5
Smiles:
O=C(CC(O)CCc1ccc(O)cc1)CC(O)CCc1ccc(O)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 2.73 | Num_rotatable_bonds: | 10 |
| MolWt: | 358.43 | Num_heavy_atoms: | 26 |
| TPSA: | 97.99 | NumAromaticRings: | 2 |
