Glycoside
GD056429
Name:
NoneFormula:
C14H19O7N3Smiles:
NC(=O)c1cc2c([nH]1)CN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)CC2Aglycone:
NC(=O)c1cc2c([nH]1)CNCC2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -3.36 | Num_rotatable_bonds: | 6 |
| MolWt: | 341.32 | Num_heavy_atoms: | 24 |
| TPSA: | 177.18 | NumAromaticRings: | 1 |
Unique Aglycone
AD28352
Formula: C8H11ON3
Smiles:
NC(=O)c1cc2c([nH]1)CNCC2| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | -0.24 | Num_rotatable_bonds: | 1 |
| MolWt: | 165.2 | Num_heavy_atoms: | 12 |
| TPSA: | 70.91 | NumAromaticRings: | 1 |
