Glycoside
GD008324
Name:
NEPHTHOSIDEFormula:
C32H48O6Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCc1cc(O[C@@H]2OC[C@H](O)[C@H](O)[C@H]2O)c(C)cc1OAglycone:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCc1cc(O)c(C)cc1OSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | 6.21 | Num_rotatable_bonds: | 13 |
| MolWt: | 528.73 | Num_heavy_atoms: | 38 |
| TPSA: | 99.38 | NumAromaticRings: | 1 |
Unique Aglycone
AD06659
Formula: C27H40O2
Smiles:
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCc1cc(O)c(C)cc1O| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.48 |
| AlogP: | 8.09 | Num_rotatable_bonds: | 11 |
| MolWt: | 396.62 | Num_heavy_atoms: | 29 |
| TPSA: | 40.46 | NumAromaticRings: | 1 |
