FID

(2S,4S)-2-AMINOFORMYL-6-FLUORO-SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-2',5'-DIONE

Created:	2000-02-14
Last modified:	2020-06-05

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11 entries where FID is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	30
Chiral Atom Count	2
Bond Count	32
Aromatic Bond Count	6

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Chemical Component Summary
Name	(2S,4S)-2-AMINOFORMYL-6-FLUORO-SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-2',5'-DIONE
Synonyms	FIDARESTAT
Systematic Name (OpenEye OEToolkits)	(2S,4S)-6-fluoro-2',5'-dioxo-spiro[chroman-4,4'-imidazolidine]-2-carboxamide
Formula	C₁₂ H₁₀ F N₃ O₄
Molecular Weight	279.224
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Fc3ccc2OC(C(=O)N)CC1(C(=O)NC(=O)N1)c2c3
SMILES	CACTVS	3.341	NC(=O)[CH]1C[C]2(NC(=O)NC2=O)c3cc(F)ccc3O1
SMILES	OpenEye OEToolkits	1.5.0	c1cc2c(cc1F)C3(CC(O2)C(=O)N)C(=O)NC(=O)N3
Canonical SMILES	CACTVS	3.341	NC(=O)[C@@H]1C[C@]2(NC(=O)NC2=O)c3cc(F)ccc3O1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc2c(cc1F)[C@@]3(C[C@H](O2)C(=O)N)C(=O)NC(=O)N3
InChI	InChI	1.03	InChI=1S/C12H10FN3O4/c13-5-1-2-7-6(3-5)12(4-8(20-7)9(14)17)10(18)15-11(19)16-12/h1-3,8H,4H2,(H2,14,17)(H2,15,16,18,19)/t8-,12-/m0/s1
InChIKey	InChI	1.03	WAAPEIZFCHNLKK-UFBFGSQYSA-N

Drug Info: DrugBank

DrugBank ID	DB02021
Name	Fidarestat
Groups	experimental
Synonyms	(S,S)-fidarestat Aldos Fidarestat
Categories	Aldehyde Reductase, antagonists & inhibitors Imidazoles
CAS number	136087-85-9

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Aldo-keto reductase family 1 member B10	MATFVELSTKAKMPIVGLGTWKSPLGKVKEAVKVAIDAGYRHIDCAYVYQ...	unknown	inhibitor
Aldose reductase	MASRLLLNNGAKMPILGLGTWKSPPGQVTEAVKVAIDVGYRHIDCAHVYQ...	unknown	inhibitor

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682