Glycoside
GD132673
Name:
2-[(1,7-dihydroxytetradeca-4,12-dien-8,10-diyn-6-yl)oxy]-6-(hydroxymethyl)-5-methyloxane-3,4-diolFormula:
C21H30O7Smiles:
CC=CC#CC#CC(O)C(C=CCCCO)OC1OC(CO)C(C)C(O)C1OAglycone:
CC=CC#CC#CC(O)C(O)C=CCCCOSugarmoiety:
CC1C(CO)OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 8 |
| MolWt: | 394.46 | Num_heavy_atoms: | 28 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD48211
Formula: C14H18O3
Smiles:
CC=CC#CC#CC(O)C(O)C=CCCCO| HBA: | 3 | RingCount: | 0 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 5 |
| MolWt: | 234.29 | Num_heavy_atoms: | 17 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
