Glycoside
GD122037
Name:
5,5-dimethyl-4-(2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}ethyl)oxolan-2-oneFormula:
C14H24O8Smiles:
CC1(C)OC(=O)CC1CCOC1OC(CO)C(O)C(O)C1OAglycone:
CC1(C)OC(=O)CC1CCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.93 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 5 |
| MolWt: | 320.34 | Num_heavy_atoms: | 22 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD49152
Formula: C8H14O3
Smiles:
CC1(C)OC(=O)CC1CCO| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.88 |
| AlogP: | 0.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 158.2 | Num_heavy_atoms: | 11 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
