Glycoside
GD150625
Name:
Dictamnoside LFormula:
C21H34O8Smiles:
CC12CCC(O)C3(CCC(C(C)(C)OC4OC(CO)C(O)C(O)C4O)C=C13)CO2Aglycone:
CC12CCC(O)C3(CCC(C(C)(C)O)C=C13)CO2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.9 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 4 |
| MolWt: | 414.5 | Num_heavy_atoms: | 29 |
| TPSA: | 128.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD60147
Formula: C15H24O3
Smiles:
CC12CCC(O)C3(CCC(C(C)(C)O)C=C13)CO2| HBA: | 3 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.87 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 1 |
| MolWt: | 252.35 | Num_heavy_atoms: | 18 |
| TPSA: | 49.69 | NumAromaticRings: | 0 |
