Glycoside
GD050239
Name:
NoneFormula:
C13H20O6N3Smiles:
CN(C)c1cc[nH+]cc1NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
CN(C)c1cc[nH+]cc1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -2.85 | Num_rotatable_bonds: | 7 |
| MolWt: | 314.32 | Num_heavy_atoms: | 22 |
| TPSA: | 144.47 | NumAromaticRings: | 1 |
Unique Aglycone
AD26559
Formula: C7H12N3
Smiles:
CN(C)c1cc[nH+]cc1N| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.29 |
| AlogP: | 0.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 138.19 | Num_heavy_atoms: | 10 |
| TPSA: | 43.4 | NumAromaticRings: | 1 |
