Glycoside
GD038386
Name:
6-fluoroanthraniloyl-ampFormula:
C17H18O8N6FPSmiles:
Nc1cccc(F)c1C(=O)OP(=O)(O)OC[C@H]1O[C@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OAglycone:
COP(=O)(O)OC(=O)c1c(N)cccc1F.Nc1ncnc2c1N=C[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.29 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 484.34 | Num_heavy_atoms: | 33 |
| TPSA: | 218.16 | NumAromaticRings: | 3 |
Unique Aglycone
AD00058
Formula: C5H4N5
Smiles:
Nc1ncnc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 0 |
| MolWt: | 134.12 | Num_heavy_atoms: | 10 |
| TPSA: | 78.26 | NumAromaticRings: | 1 |
AD24005
Formula: C8H9O5NFP
Smiles:
COP(=O)(O)OC(=O)c1c(N)cccc1F| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 3 |
| MolWt: | 249.13 | Num_heavy_atoms: | 16 |
| TPSA: | 98.85 | NumAromaticRings: | 1 |
