Glycoside
GD114158
Name:
IrpexanFormula:
C36H62O7Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(OC1OC(CO)C(O)C(O)C1O)C(C)(O)CCC=C(C)CCC=C(C)CAglycone:
CC(C)=CCCC(C)=CCCC(C)=CCCC(O)C(C)(O)CCC=C(C)CCC=C(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.72 |
| AlogP: | 6.59 | Num_rotatable_bonds: | 19 |
| MolWt: | 606.88 | Num_heavy_atoms: | 43 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD44866
Formula: C30H52O2
Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(O)C(C)(O)CCC=C(C)CCC=C(C)C| HBA: | 2 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | 8.77 | Num_rotatable_bonds: | 16 |
| MolWt: | 444.74 | Num_heavy_atoms: | 32 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
