Glycoside
GD082071
Name:
NoneFormula:
C18H30O8N2Smiles:
CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)C1Aglycone:
CC(C)(C)OC(=O)N1CCC2(CC2C(N)=O)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.89 |
| AlogP: | -1.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 402.44 | Num_heavy_atoms: | 28 |
| TPSA: | 148.79 | NumAromaticRings: | 0 |
Unique Aglycone
AD36848
Formula: C12H20O3N2
Smiles:
CC(C)(C)OC(=O)N1CCC2(CC2C(N)=O)C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.83 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 240.3 | Num_heavy_atoms: | 17 |
| TPSA: | 72.63 | NumAromaticRings: | 0 |
