Glycoside
GD137538
Name:
3-(3-hydroxy-4-{[6-(hydroxymethyl)-[2,2'-bioxane]-3,3',4,4',5,5'-hexyl]oxy}phenyl)-1-phenylprop-2-en-1-oneFormula:
C26H30O12Smiles:
O=C(C=Cc1ccc(OC2(C3OCC(O)C(O)C3O)OC(CO)C(O)C(O)C2O)c(O)c1)c1ccccc1Aglycone:
O=C(C=Cc1ccc(O)c(O)c1)c1ccccc1Sugarmoiety:
OCC1OC(O)(C2OCC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 8 | FractionCSP3: | 0.42 |
| AlogP: | -1.68 | Num_rotatable_bonds: | 7 |
| MolWt: | 534.51 | Num_heavy_atoms: | 38 |
| TPSA: | 206.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD52744
Formula: C15H12O3
Smiles:
O=C(C=Cc1ccc(O)c(O)c1)c1ccccc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.99 | Num_rotatable_bonds: | 3 |
| MolWt: | 240.26 | Num_heavy_atoms: | 18 |
| TPSA: | 57.53 | NumAromaticRings: | 2 |
