Glycoside

GD026297
Name:
ARGELOSIDE FFormula:
C54H86O22Smiles:
CO[C@H]1C[C@@H](O[C@@H]2[C@@H](C)O[C@@H](O[C@H]3[C@H](C)O[C@@H](O[C@@H]4CC[C@]5(C)C(=CC[C@@H]6[C@H]5CC[C@]5(C)[C@@H]7[C@@H]8CO[C@@]7(C)O[C@@]65O8)C4)C[C@H]3O)C[C@H]2OC)O[C@@H](C)[C@H]1O[C@@H]1O[C@H](C)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](OC)[C@H]1OAglycone:
CC12OCC3OC4(O1)C1CC=C5CC(O)CCC5(C)C1CCC4(C)C32Sugarmoiety:
COC1CC(OC2C(O)CC(O)OC2C)OC(C)C1OC1CC(OC)C(OC2OC(C)C(OC3OC(CO)C(O)C(O)C3O)C(OC)C2O)C(C)O1Other Identifiers
Properties
HBA: | 22 | RingCount: | 11 |
HBD: | 6 | FractionCSP3: | 0.96 |
AlogP: | 1.67 | Num_rotatable_bonds: | 14 |
MolWt: | 1087.26 | Num_heavy_atoms: | 76 |
TPSA: | 269.06 | NumAromaticRings: | 0 |
Unique Aglycone
AD17343
Formula: C21H30O4
Smiles:
CC12OCC3OC4(O1)C1CC=C5CC(O)CCC5(C)C1CCC4(C)C32HBA: | 4 | RingCount: | 6 |
HBD: | 1 | FractionCSP3: | 0.9 |
AlogP: | 3.39 | Num_rotatable_bonds: | 0 |
MolWt: | 346.47 | Num_heavy_atoms: | 25 |
TPSA: | 47.92 | NumAromaticRings: | 0 |
Sugarmoiety

SD02698
COC1CC(OC2C(O)CC(O)OC2C)OC(C)C1OC1CC(OC)C(OC2OC(C)C(OC3OC(CO)C(O)C(O)C3O)C(OC)C2O)C(C)O1