Glycoside
GD123883
Name:
Panaxfurayne AFormula:
C23H32O12Smiles:
CC=CC#CC#CC1(OC2OC(CO)C(O)C(O)C2OC2OC(CO)C(O)C(O)C2O)CCCO1Aglycone:
CC=CC#CC#CC1(O)CCCO1Sugarmoiety:
OCC1OC(OC2C(O)OC(CO)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.74 |
| AlogP: | -3.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 500.5 | Num_heavy_atoms: | 35 |
| TPSA: | 187.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD50021
Formula: C11H12O2
Smiles:
CC=CC#CC#CC1(O)CCCO1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.45 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 0 |
| MolWt: | 176.21 | Num_heavy_atoms: | 13 |
| TPSA: | 29.46 | NumAromaticRings: | 0 |
