Glycoside
GD017850
Name:
CitreoviralFormula:
C11H18O4Smiles:
CC(C=O)=C[C@@]1(C)O[C@H](C)[C@@](C)(O)[C@H]1OAglycone:
C=C(C)C=OSugarmoiety:
CC1OC(C)(O)C(O)C1(C)OOther Identifiers
Properties
| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.73 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 214.26 | Num_heavy_atoms: | 15 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
Unique Aglycone
AD12691
Formula: C4H6O
Smiles:
C=C(C)C=O| HBA: | 1 | RingCount: | 0 |
| HBD: | 0 | FractionCSP3: | 0.25 |
| AlogP: | 0.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 70.09 | Num_heavy_atoms: | 5 |
| TPSA: | 17.07 | NumAromaticRings: | 0 |
