Glycoside
GD122004
Name:
methyl 2,6-dimethyl-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}octa-2,7-dienoateFormula:
C17H28O8Smiles:
C=CC(C)(CCC=C(C)C(=O)OC)OC1OC(CO)C(O)C(O)C1OAglycone:
C=CC(C)(O)CCC=C(C)C(=O)OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.71 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 8 |
| MolWt: | 360.4 | Num_heavy_atoms: | 25 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD16362
Formula: C11H18O3
Smiles:
C=CC(C)(O)CCC=C(C)C(=O)OC| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.55 |
| AlogP: | 1.82 | Num_rotatable_bonds: | 5 |
| MolWt: | 198.26 | Num_heavy_atoms: | 14 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
