Glycoside
GD135044
Name:
Pierisformoside EFormula:
C26H40O9Smiles:
C=C1C2CCC3CC2(CC3(C)OC2OC(CO)C(O)C(O)C2O)CC2(O)C(=O)C(C)(C)C(O)CC12Aglycone:
C=C1C2CCC3CC2(CC3(C)O)CC2(O)C(=O)C(C)(C)C(O)CC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | 0.04 | Num_rotatable_bonds: | 3 |
| MolWt: | 496.6 | Num_heavy_atoms: | 35 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD54620
Formula: C20H30O4
Smiles:
C=C1C2CCC3CC2(CC3(C)O)CC2(O)C(=O)C(C)(C)C(O)CC12| HBA: | 4 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.85 |
| AlogP: | 2.21 | Num_rotatable_bonds: | 0 |
| MolWt: | 334.46 | Num_heavy_atoms: | 24 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
