Glycoside
GD050718
Name:
NoneFormula:
C13H14O6N4Smiles:
N#CN/C(=N\C(=O)/C(O)=C(\O)[C@@H](O)[C@H](O)CO)c1ccncc1Aglycone:
N#CNC(=NC(=O)CO)c1ccncc1Sugarmoiety:
O=C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.23 |
| AlogP: | -1.53 | Num_rotatable_bonds: | 5 |
| MolWt: | 322.28 | Num_heavy_atoms: | 23 |
| TPSA: | 179.29 | NumAromaticRings: | 1 |
Unique Aglycone
AD26706
Formula: C9H8O2N4
Smiles:
N#CNC(=NC(=O)CO)c1ccncc1| HBA: | 6 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | -0.58 | Num_rotatable_bonds: | 2 |
| MolWt: | 204.19 | Num_heavy_atoms: | 15 |
| TPSA: | 98.37 | NumAromaticRings: | 1 |
