Glycoside
GD131709
Name:
Helichrysetin 4,4'-Di-O-Alpha-GlucosideFormula:
C28H34O15Smiles:
COc1cc(OC2OC(CO)C(O)C(O)C2O)cc(O)c1C(=O)C=Cc1ccc(OC2OC(CO)C(O)C(O)C2O)cc1Aglycone:
COc1cc(O)cc(O)c1C(=O)C=Cc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.46 |
| AlogP: | -2.35 | Num_rotatable_bonds: | 10 |
| MolWt: | 610.57 | Num_heavy_atoms: | 43 |
| TPSA: | 245.29 | NumAromaticRings: | 2 |
Unique Aglycone
AD53342
Formula: C16H14O5
Smiles:
COc1cc(O)cc(O)c1C(=O)C=Cc1ccc(O)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.06 |
| AlogP: | 2.71 | Num_rotatable_bonds: | 4 |
| MolWt: | 286.28 | Num_heavy_atoms: | 21 |
| TPSA: | 86.99 | NumAromaticRings: | 2 |
