Glycoside
GD132977
Name:
2-({[5-(1,2-dihydroxyethyl)-3,4-dihydroxyoxolan-2-yl]oxy}methyl)-6-(octyloxy)oxane-3,4,5-triolFormula:
C20H38O11Smiles:
CCCCCCCCOC1OC(COC2OC(C(O)CO)C(O)C2O)C(O)C(O)C1OAglycone:
CCCCCCCCOSugarmoiety:
OCC(O)C1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 13 |
| MolWt: | 454.51 | Num_heavy_atoms: | 31 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD00023
Formula: C8H18O
Smiles:
CCCCCCCCO| HBA: | 1 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 2.34 | Num_rotatable_bonds: | 6 |
| MolWt: | 130.23 | Num_heavy_atoms: | 9 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
