Glycoside
GD124800
Name:
2-[2-hydroxy-2-(4-methylcyclohex-3-en-1-yl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C16H28O7Smiles:
CC1=CCC(C(C)(O)COC2OC(CO)C(O)C(O)C2O)CC1Aglycone:
CC1=CCC(C(C)(O)CO)CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.88 |
| AlogP: | -0.7 | Num_rotatable_bonds: | 5 |
| MolWt: | 332.39 | Num_heavy_atoms: | 23 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD50439
Formula: C10H18O2
Smiles:
CC1=CCC(C(C)(O)CO)CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.8 |
| AlogP: | 1.48 | Num_rotatable_bonds: | 2 |
| MolWt: | 170.25 | Num_heavy_atoms: | 12 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
