Glycoside
GD007301
Name:
NoneFormula:
C40H68O12NSmiles:
C#CC[N+](C)(C)[C@@H]1C[C@H](C)O[C@H](O[C@@H]2C(C)C(O[C@@H]3C[C@@](C)(OC)[C@H](O)[C@H](C)O3)C(C)C(=O)OC(CC)[C@@](C)(O)[C@H](O)[C@H](C)C3=C(C)C[C@@]2(C)O3)[C@H]1OAglycone:
C#CC[N+](C)(C)C1CC(C)OC(OC2C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C3=C(C)CC2(C)O3)C1OSugarmoiety:
COC1(C)CC(O)OC(C)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.88 |
| AlogP: | 3.04 | Num_rotatable_bonds: | 8 |
| MolWt: | 754.98 | Num_heavy_atoms: | 53 |
| TPSA: | 162.6 | NumAromaticRings: | 0 |
Unique Aglycone
AD05956
Formula: C32H54O9N
Smiles:
C#CC[N+](C)(C)C1CC(C)OC(OC2C(C)C(O)C(C)C(=O)OC(CC)C(C)(O)C(O)C(C)C3=C(C)CC2(C)O3)C1O| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.84 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 5 |
| MolWt: | 596.78 | Num_heavy_atoms: | 42 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
