Glycoside
GD157840
Name:
Peucedanoside BFormula:
C20H24O11Smiles:
CC(O)(COC1OC(CO)C(O)C(O)C1O)C1Oc2ccc3ccc(=O)oc3c2C1OAglycone:
CC(O)(CO)C1Oc2ccc3ccc(=O)oc3c2C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.55 |
| AlogP: | -1.85 | Num_rotatable_bonds: | 5 |
| MolWt: | 440.4 | Num_heavy_atoms: | 31 |
| TPSA: | 179.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD62361
Formula: C14H14O6
Smiles:
CC(O)(CO)C1Oc2ccc3ccc(=O)oc3c2C1O| HBA: | 6 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.36 |
| AlogP: | 0.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 278.26 | Num_heavy_atoms: | 20 |
| TPSA: | 100.13 | NumAromaticRings: | 2 |
