Glycoside
GD138382
Name:
3,6-dimethyl-3-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)cycloheptan-1-oneFormula:
C16H28O7Smiles:
CC1CCC(C)(COC2OC(CO)C(O)C(O)C2O)CC(=O)C1Aglycone:
CC1CCC(C)(CO)CC(=O)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.94 |
| AlogP: | -0.41 | Num_rotatable_bonds: | 4 |
| MolWt: | 332.39 | Num_heavy_atoms: | 23 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD55866
Formula: C10H18O2
Smiles:
CC1CCC(C)(CO)CC(=O)C1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.9 |
| AlogP: | 1.76 | Num_rotatable_bonds: | 1 |
| MolWt: | 170.25 | Num_heavy_atoms: | 12 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
