Glycoside
GD122012
Name:
2-(dec-8-en-4,6-diyn-1-yloxy)-6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)oxane-3,4,5-triolFormula:
C21H30O10Smiles:
CC=CC#CC#CCCCOC1OC(COC2OCC(O)(CO)C2O)C(O)C(O)C1OAglycone:
CC=CC#CC#CCCCOSugarmoiety:
OCC1(O)COC(OCC2OC(O)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.71 |
| AlogP: | -2.37 | Num_rotatable_bonds: | 8 |
| MolWt: | 442.46 | Num_heavy_atoms: | 31 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD06089
Formula: C10H12O
Smiles:
CC=CC#CC#CCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 1.34 | Num_rotatable_bonds: | 2 |
| MolWt: | 148.2 | Num_heavy_atoms: | 11 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
