Details
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=CC=CC=C4F)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
Approval Year
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4GR4LS9SWP
Created by
admin on Sat Dec 16 16:36:06 GMT 2023 , Edited by admin on Sat Dec 16 16:36:06 GMT 2023
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91971711
Created by
admin on Sat Dec 16 16:36:06 GMT 2023 , Edited by admin on Sat Dec 16 16:36:06 GMT 2023
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PRIMARY |
PARENT (METABOLITE)
SUBSTANCE RECORD