Glycoside
GD120094
Name:
2-({5-hydroxy-2-methyl-3,9-dioxatricyclo[4.4.0.0²,â´]dec-7-en-10-yl}oxy)-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C15H22O9Smiles:
CC12OC1C(O)C1C=COC(OC3OC(CO)C(O)C(O)C3O)C12Aglycone:
CC12OC1C(O)C1C=COC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.87 |
| AlogP: | -2.56 | Num_rotatable_bonds: | 3 |
| MolWt: | 346.33 | Num_heavy_atoms: | 24 |
| TPSA: | 141.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD48202
Formula: C9H12O4
Smiles:
CC12OC1C(O)C1C=COC(O)C12| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.78 |
| AlogP: | -0.39 | Num_rotatable_bonds: | 0 |
| MolWt: | 184.19 | Num_heavy_atoms: | 13 |
| TPSA: | 62.22 | NumAromaticRings: | 0 |
