Glycoside
GD148229
Name:
BoschniasideFormula:
C16H26O7Smiles:
CC1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)CCC12Aglycone:
CC1=COC(O)C2C(C)CCC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 3 |
| MolWt: | 330.38 | Num_heavy_atoms: | 23 |
| TPSA: | 108.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD59325
Formula: C10H16O2
Smiles:
CC1=COC(O)C2C(C)CCC12| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 1.9 | Num_rotatable_bonds: | 0 |
| MolWt: | 168.24 | Num_heavy_atoms: | 12 |
| TPSA: | 29.46 | NumAromaticRings: | 0 |
