Glycoside
GD146076
Name:
2-{[5-(1,2-dihydroxypropan-2-yl)-2-methylcyclohexyl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H30O8Smiles:
CC1CCC(C(C)(O)CO)CC1OC1OC(CO)C(O)C(O)C1OAglycone:
CC1CCC(C(C)(O)CO)CC1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -1.65 | Num_rotatable_bonds: | 5 |
| MolWt: | 350.41 | Num_heavy_atoms: | 24 |
| TPSA: | 139.84 | NumAromaticRings: | 0 |
Unique Aglycone
AD53308
Formula: C10H20O3
Smiles:
CC1CCC(C(C)(O)CO)CC1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.53 | Num_rotatable_bonds: | 2 |
| MolWt: | 188.27 | Num_heavy_atoms: | 13 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
