Glycoside
GD155082
Name:
2-{[4-hydroxy-4-(2,6,6-trimethyl-4-methylidenecyclohex-2-en-1-yl)butan-2-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C20H34O7Smiles:
C=C1C=C(C)C(C(O)CC(C)OC2OC(CO)C(O)C(O)C2O)C(C)(C)C1Aglycone:
C=C1C=C(C)C(C(O)CC(C)O)C(C)(C)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.8 |
| AlogP: | 0.49 | Num_rotatable_bonds: | 6 |
| MolWt: | 386.49 | Num_heavy_atoms: | 27 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD61543
Formula: C14H24O2
Smiles:
C=C1C=C(C)C(C(O)CC(C)O)C(C)(C)C1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.71 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 3 |
| MolWt: | 224.34 | Num_heavy_atoms: | 16 |
| TPSA: | 40.46 | NumAromaticRings: | 0 |
