Glycoside
GD039623
Name:
2-(6-(2-cyclohexylethoxy)-tetrahydro-4,5-dihydroxy-2(hydroxymethyl)-2h-pyran-3-yloxy)-tetrahydro-6(hydroxymethyl)-2h-py ran-3,4,5-triolFormula:
C20H36O11Smiles:
OC[C@H]1O[C@H](O[C@H]2[C@@H](CO)O[C@H](OCCC3CCCCC3)[C@@H](O)[C@H]2O)[C@@H](O)[C@@H](O)[C@H]1OAglycone:
OCCC1CCCCC1Sugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 1.0 |
| AlogP: | -2.4 | Num_rotatable_bonds: | 8 |
| MolWt: | 452.5 | Num_heavy_atoms: | 31 |
| TPSA: | 178.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD21762
Formula: C8H16O
Smiles:
OCCC1CCCCC1| HBA: | 1 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 1.95 | Num_rotatable_bonds: | 2 |
| MolWt: | 128.22 | Num_heavy_atoms: | 9 |
| TPSA: | 20.23 | NumAromaticRings: | 0 |
