Glycoside

GD155542
Name:
NoneFormula:
C69H110O35Smiles:
C=C1CCC2(C(=O)OC3OC(COC4OC(CO)C(OC5OC(C)C(O)C(O)C5O)C(O)C4O)C(O)C(O)C3O)CCC3(C)C(=CCC4C5(C)CCC(OC6OCC(O)C(OC7OC(CO)C(OC8OC(CO)C(O)C(OC9OCC(O)C(O)C9O)C8O)C(O)C7O)C6O)C(C)(C)C5CCC43C)C2C1Aglycone:
C=C1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1Sugarmoiety:
CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(OC3C(O)COC(O)C3O)C(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1OOther Identifiers
Properties
HBA: | 35 | RingCount: | 12 |
HBD: | 20 | FractionCSP3: | 0.93 |
AlogP: | -6.73 | Num_rotatable_bonds: | 18 |
MolWt: | 1499.6 | Num_heavy_atoms: | 104 |
TPSA: | 550.89 | NumAromaticRings: | 0 |
Unique Aglycone
AD05107
Formula: C29H44O3
Smiles:
C=C1CCC2(C(=O)O)CCC3(C)C(=CCC4C5(C)CCC(O)C(C)(C)C5CCC43C)C2C1HBA: | 3 | RingCount: | 5 |
HBD: | 2 | FractionCSP3: | 0.83 |
AlogP: | 6.76 | Num_rotatable_bonds: | 1 |
MolWt: | 440.67 | Num_heavy_atoms: | 32 |
TPSA: | 57.53 | NumAromaticRings: | 0 |
Sugarmoiety

SD07635
CC1OC(OC2C(CO)OC(OCC3OC(O)C(O)C(O)C3O)C(O)C2O)C(O)C(O)C1O.OCC1OC(OC2C(CO)OC(OC3C(O)COC(O)C3O)C(O)C2O)C(O)C(OC2OCC(O)C(O)C2O)C1O