Glycoside
GD117765
Name:
NoneFormula:
C39H64O13Smiles:
CC(C)CCCC(C)C1CCC2C3C(O)C=C4CC(OC5OC(CO)C(O)C(COC6OC(CO)C(O)C6O)C5O)CCC4(C(=O)O)C3CCC12CAglycone:
CC(C)CCCC(C)C1CCC2C3C(O)C=C4CC(O)CCC4(C(=O)O)C3CCC12CSugarmoiety:
OCC1OC(OCC2C(O)C(O)OC(CO)C2O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 6 |
| HBD: | 8 | FractionCSP3: | 0.92 |
| AlogP: | 1.96 | Num_rotatable_bonds: | 13 |
| MolWt: | 740.93 | Num_heavy_atoms: | 52 |
| TPSA: | 215.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD46996
Formula: C27H44O4
Smiles:
CC(C)CCCC(C)C1CCC2C3C(O)C=C4CC(O)CCC4(C(=O)O)C3CCC12C| HBA: | 4 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.89 |
| AlogP: | 5.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 432.65 | Num_heavy_atoms: | 31 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
