Glycoside
GD058394
Name:
NoneFormula:
C15H23O7N2Smiles:
C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)COAglycone:
CC([NH3+])Cc1ccccc1[N+](=O)[O-]Sugarmoiety:
O=CC([OH2+])C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -2.27 | Num_rotatable_bonds: | 10 |
| MolWt: | 343.36 | Num_heavy_atoms: | 24 |
| TPSA: | 157.74 | NumAromaticRings: | 1 |
Unique Aglycone
AD29198
Formula: C9H13O2N2
Smiles:
CC([NH3+])Cc1ccccc1[N+](=O)[O-]| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.33 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 181.21 | Num_heavy_atoms: | 13 |
| TPSA: | 70.78 | NumAromaticRings: | 1 |
