Glycoside
GD122767
Name:
6-ethyl-3,4,5-trihydroxyoxan-2-yl 2-methylbut-2-enoateFormula:
C12H20O6Smiles:
CC=C(C)C(=O)OC1OC(CC)C(O)C(O)C1OAglycone:
CC=C(C)C(=O)OSugarmoiety:
CCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.75 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 260.29 | Num_heavy_atoms: | 18 |
| TPSA: | 96.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD00342
Formula: C5H8O2
Smiles:
CC=C(C)C(=O)O| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 1.04 | Num_rotatable_bonds: | 1 |
| MolWt: | 100.12 | Num_heavy_atoms: | 7 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
