Glycoside
GD031839
Name:
NoneFormula:
C36H59O8NSmiles:
CC(C)=CCC[C@@](C)(O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@@H]1CC[C@]2(C)[C@H]1C(=O)C[C@@H]1[C@]3(C)CCC(=NO)C(C)(C)[C@H]3CC[C@]12CAglycone:
CC(C)=CCCC(C)(O)C1CCC2(C)C1C(=O)CC1C3(C)CCC(=NO)C(C)(C)C3CCC12CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | 5.0 | Num_rotatable_bonds: | 7 |
| MolWt: | 633.87 | Num_heavy_atoms: | 45 |
| TPSA: | 149.04 | NumAromaticRings: | 0 |
Unique Aglycone
AD20481
Formula: C30H49O3N
Smiles:
CC(C)=CCCC(C)(O)C1CCC2(C)C1C(=O)CC1C3(C)CCC(=NO)C(C)(C)C3CCC12C| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.87 |
| AlogP: | 7.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 471.73 | Num_heavy_atoms: | 34 |
| TPSA: | 69.89 | NumAromaticRings: | 0 |
