Glycoside
GD057826
Name:
NoneFormula:
C16H23O6N2Smiles:
[NH3+]C[C@@H]1Cc2ccccc2CN1C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
[NH3+]CC1Cc2ccccc2CN1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -3.17 | Num_rotatable_bonds: | 6 |
| MolWt: | 339.37 | Num_heavy_atoms: | 24 |
| TPSA: | 145.94 | NumAromaticRings: | 1 |
Unique Aglycone
AD29015
Formula: C10H15N2
Smiles:
[NH3+]CC1Cc2ccccc2CN1| HBA: | 2 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 1 |
| MolWt: | 163.24 | Num_heavy_atoms: | 12 |
| TPSA: | 39.67 | NumAromaticRings: | 1 |
