Glycoside
GD135500
Name:
12-Hydroxyjasmonic Acid 12-O-Beta-D-GlucosideFormula:
C19H30O8Smiles:
CCC1OC(OCCC=CCC2C(=O)CCC2CC(=O)O)C(O)C(O)C1OAglycone:
O=C(O)CC1CCC(=O)C1CC=CCCOSugarmoiety:
CCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 9 |
| MolWt: | 386.44 | Num_heavy_atoms: | 27 |
| TPSA: | 133.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD08439
Formula: C12H18O4
Smiles:
O=C(O)CC1CCC(=O)C1CC=CCCO| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | 1.39 | Num_rotatable_bonds: | 6 |
| MolWt: | 226.27 | Num_heavy_atoms: | 16 |
| TPSA: | 74.6 | NumAromaticRings: | 0 |
