Glycoside
GD145218
Name:
2-{[2-hydroxy-5-(2-hydroxypropan-2-yl)-2-methylcyclohexyl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H30O8Smiles:
CC(C)(O)C1CCC(C)(O)C(OC2OC(CO)C(O)C(O)C2O)C1Aglycone:
CC(C)(O)C1CCC(C)(O)C(O)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -1.51 | Num_rotatable_bonds: | 4 |
| MolWt: | 350.41 | Num_heavy_atoms: | 24 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD16869
Formula: C10H20O3
Smiles:
CC(C)(O)C1CCC(C)(O)C(O)C1| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 188.27 | Num_heavy_atoms: | 13 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
