Glycoside
GD081590
Name:
NoneFormula:
C18H30O9N2Smiles:
CC(C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)C2)C1Aglycone:
CC(C)C(=O)N1CCOC2(CNCCOC2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.83 |
| AlogP: | -3.26 | Num_rotatable_bonds: | 6 |
| MolWt: | 418.44 | Num_heavy_atoms: | 29 |
| TPSA: | 157.07 | NumAromaticRings: | 0 |
Unique Aglycone
AD36711
Formula: C12H22O3N2
Smiles:
CC(C)C(=O)N1CCOC2(CNCCOC2)C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.92 |
| AlogP: | -0.14 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.32 | Num_heavy_atoms: | 17 |
| TPSA: | 50.8 | NumAromaticRings: | 0 |
