Glycoside
GD140171
Name:
Syringopicroside CFormula:
C25H32O13Smiles:
COC(COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C)C(=O)CC12)c1ccc(O)c(O)c1Aglycone:
COC(COC(=O)C1=COC(O)C2C(C)C(=O)CC12)c1ccc(O)c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.6 |
| AlogP: | -0.77 | Num_rotatable_bonds: | 8 |
| MolWt: | 540.52 | Num_heavy_atoms: | 38 |
| TPSA: | 201.67 | NumAromaticRings: | 1 |
Unique Aglycone
AD56516
Formula: C19H22O8
Smiles:
COC(COC(=O)C1=COC(O)C2C(C)C(=O)CC12)c1ccc(O)c(O)c1| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.47 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 5 |
| MolWt: | 378.38 | Num_heavy_atoms: | 27 |
| TPSA: | 122.52 | NumAromaticRings: | 1 |
