Glycoside
GD057804
Name:
NoneFormula:
C16H31O6N2Smiles:
CC(C)CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)[C@H]1CC[C@H]([NH3+])CC1Aglycone:
CC(C)CNC1CCC([NH3+])CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 7 | FractionCSP3: | 0.88 |
| AlogP: | -2.33 | Num_rotatable_bonds: | 8 |
| MolWt: | 347.43 | Num_heavy_atoms: | 24 |
| TPSA: | 145.94 | NumAromaticRings: | 0 |
Unique Aglycone
AD29009
Formula: C10H23N2
Smiles:
CC(C)CNC1CCC([NH3+])CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 1.0 |
| AlogP: | 0.79 | Num_rotatable_bonds: | 3 |
| MolWt: | 171.31 | Num_heavy_atoms: | 12 |
| TPSA: | 39.67 | NumAromaticRings: | 0 |
