Glycoside
GD135411
Name:
Pteroside PFormula:
C20H28O8Smiles:
Cc1c(CCOC2OC(CO)C(O)C(O)C2O)c(CO)cc2c1C(=O)C(C)C2Aglycone:
Cc1c(CCO)c(CO)cc2c1C(=O)C(C)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -0.78 | Num_rotatable_bonds: | 6 |
| MolWt: | 396.44 | Num_heavy_atoms: | 28 |
| TPSA: | 136.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD54753
Formula: C14H18O3
Smiles:
Cc1c(CCO)c(CO)cc2c1C(=O)C(C)C2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 234.29 | Num_heavy_atoms: | 17 |
| TPSA: | 57.53 | NumAromaticRings: | 1 |
