Glycoside
GD121565
Name:
methyl 3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,10,12-trioxatricyclo[7.2.1.0²,â·]dodec-5-ene-6-carboxylateFormula:
C17H24O11Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C3COC(CC12)O3Aglycone:
COC(=O)C1=COC(O)C2C3COC(CC12)O3Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | -2.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 404.37 | Num_heavy_atoms: | 28 |
| TPSA: | 153.37 | NumAromaticRings: | 0 |
Unique Aglycone
AD48943
Formula: C11H14O6
Smiles:
COC(=O)C1=COC(O)C2C3COC(CC12)O3| HBA: | 6 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.73 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.23 | Num_heavy_atoms: | 17 |
| TPSA: | 74.22 | NumAromaticRings: | 0 |
