Glycoside
GD140208
Name:
NoneFormula:
C16H25O6N2Smiles:
C[NH+]1CCCC1C1=CC=CN(C2OC(C(=O)O)C(O)C(O)C2O)C1Aglycone:
C[NH+]1CCCC1C1=CC=CNC1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -2.69 | Num_rotatable_bonds: | 3 |
| MolWt: | 341.38 | Num_heavy_atoms: | 24 |
| TPSA: | 114.9 | NumAromaticRings: | 0 |
Unique Aglycone
AD56532
Formula: C10H17N2
Smiles:
C[NH+]1CCCC1C1=CC=CNC1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.6 |
| AlogP: | -0.29 | Num_rotatable_bonds: | 1 |
| MolWt: | 165.26 | Num_heavy_atoms: | 12 |
| TPSA: | 16.47 | NumAromaticRings: | 0 |
