Glycoside
GD055199
Name:
NoneFormula:
C16H22O6N2Smiles:
CN(CC/C=C/c1cccnc1)C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
CNCCC=Cc1cccnc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.44 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 9 |
| MolWt: | 338.36 | Num_heavy_atoms: | 24 |
| TPSA: | 131.19 | NumAromaticRings: | 1 |
Unique Aglycone
AD27988
Formula: C10H14N2
Smiles:
CNCCC=Cc1cccnc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.3 |
| AlogP: | 1.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 162.24 | Num_heavy_atoms: | 12 |
| TPSA: | 24.92 | NumAromaticRings: | 1 |
