Glycoside
GD123543
Name:
4-MethylantirrhinosideFormula:
C16H24O10Smiles:
CC1=COC(OC2OC(CO)C(O)C(O)C2O)C2C3(C)OC3C(O)C12OAglycone:
CC1=COC(O)C2C3(C)OC3C(O)C12OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -3.06 | Num_rotatable_bonds: | 3 |
| MolWt: | 376.36 | Num_heavy_atoms: | 26 |
| TPSA: | 161.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD49873
Formula: C10H14O5
Smiles:
CC1=COC(O)C2C3(C)OC3C(O)C12O| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.8 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 0 |
| MolWt: | 214.22 | Num_heavy_atoms: | 15 |
| TPSA: | 82.45 | NumAromaticRings: | 0 |
