Glycoside
GD120000
Name:
2-(deca-4,6-diyn-1-yloxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triolFormula:
C22H34O10Smiles:
CCCC#CC#CCCCOC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1OAglycone:
CCCC#CC#CCCCOSugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.82 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 8 |
| MolWt: | 458.5 | Num_heavy_atoms: | 32 |
| TPSA: | 158.3 | NumAromaticRings: | 0 |
Unique Aglycone
AD46525
Formula: C10H14O
Smiles:
CCCC#CC#CCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 150.22 | Num_heavy_atoms: | 11 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
