Glycoside
GD141661
Name:
4,5-dihydroxy-2-[(3,7,11-trimethyl-9-oxododeca-1,6,10-trien-3-yl)oxy]oxan-3-yl acetateFormula:
C22H34O7Smiles:
C=CC(C)(CCC=C(C)CC(=O)C=C(C)C)OC1OCC(O)C(O)C1OC(C)=OAglycone:
C=CC(C)(O)CCC=C(C)CC(=O)C=C(C)CSugarmoiety:
CC(=O)OC1C(O)OCC(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.64 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 10 |
| MolWt: | 410.51 | Num_heavy_atoms: | 29 |
| TPSA: | 102.29 | NumAromaticRings: | 0 |
Unique Aglycone
AD23571
Formula: C15H24O2
Smiles:
C=CC(C)(O)CCC=C(C)CC(=O)C=C(C)C| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.53 |
| AlogP: | 3.58 | Num_rotatable_bonds: | 7 |
| MolWt: | 236.35 | Num_heavy_atoms: | 17 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
