Glycoside
GD135460
Name:
Dictamnoside GFormula:
C27H46O14Smiles:
C=C1CCC(O)C2(CO)CCC(C(C)(C)O)C(OC3OC(COC4OC(CO)C(O)C(O)C4O)C(O)C(O)C3O)C12Aglycone:
C=C1CCC(O)C2(CO)CCC(C(C)(C)O)C(O)C12Sugarmoiety:
OCC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.93 |
| AlogP: | -3.52 | Num_rotatable_bonds: | 8 |
| MolWt: | 594.65 | Num_heavy_atoms: | 41 |
| TPSA: | 239.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD54771
Formula: C15H26O4
Smiles:
C=C1CCC(O)C2(CO)CCC(C(C)(C)O)C(O)C12| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.87 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 2 |
| MolWt: | 270.37 | Num_heavy_atoms: | 19 |
| TPSA: | 80.92 | NumAromaticRings: | 0 |
