Glycoside
GD119930
Name:
RubiginosideFormula:
C38H64O18Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCOC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1OC1OC(C)C(O)C(O)C1OAglycone:
CC(C)=CCCC(C)=CCCC(C)=CCOSugarmoiety:
CC1OC(OCC2OC(O)C(OC3OC(C)C(O)C(O)C3O)C(OC3OCC(O)C(O)C3O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.84 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 16 |
| MolWt: | 808.91 | Num_heavy_atoms: | 56 |
| TPSA: | 276.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD45904
Formula: C15H26O
Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 4.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 222.37 | Num_heavy_atoms: | 16 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
