Glycoside
GD131653
Name:
Junceelloside DFormula:
C32H54O7Smiles:
CC(CCCC(C)(C)O)C1CCC2C3CC=C4CC(OC5OCC(O)C(O)C5O)CCC4(CO)C3CCC12CAglycone:
CC(CCCC(C)(C)O)C1CCC2C3CC=C4CC(O)CCC4(CO)C3CCC12CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.94 |
| AlogP: | 3.94 | Num_rotatable_bonds: | 8 |
| MolWt: | 550.78 | Num_heavy_atoms: | 39 |
| TPSA: | 119.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD45098
Formula: C27H46O3
Smiles:
CC(CCCC(C)(C)O)C1CCC2C3CC=C4CC(O)CCC4(CO)C3CCC12C| HBA: | 3 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.93 |
| AlogP: | 5.48 | Num_rotatable_bonds: | 6 |
| MolWt: | 418.66 | Num_heavy_atoms: | 30 |
| TPSA: | 60.69 | NumAromaticRings: | 0 |
