Stereochemistry | ABSOLUTE |
Molecular Formula | C21H17FN2O9 |
Molecular Weight | 460.3661 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O[C@H]1[C@H](OC(=O)C2=CC(=CC=C2)C3=NOC(=N3)C4=C(F)C=CC=C4)O[C@@H]([C@@H](O)[C@@H]1O)C(O)=O
InChI
InChIKey=ICFGGJVKTWGVPT-FKAQHNMISA-N
InChI=1S/C21H17FN2O9/c22-12-7-2-1-6-11(12)18-23-17(24-33-18)9-4-3-5-10(8-9)20(30)32-21-15(27)13(25)14(26)16(31-21)19(28)29/h1-8,13-16,21,25-27H,(H,28,29)/t13-,14-,15+,16-,21-/m0/s1
Molecular Formula | C21H17FN2O9 |
Molecular Weight | 460.3661 |
Charge | 0 |
Count |
MOL RATIO
1 MOL RATIO (average) |
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 5 / 5 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |