SBI

SORBINIL

Created:	1999-07-08
Last modified:	2011-06-04

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3 entries where SBI is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	1
Bond Count	28
Aromatic Bond Count	6

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Chemical Component Summary
Name	SORBINIL
Systematic Name (OpenEye OEToolkits)	(4S)-6-fluorospiro[chroman-4,5'-imidazolidine]-2',4'-dione
Formula	C₁₁ H₉ F N₂ O₃
Molecular Weight	236.199
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	Fc3ccc2OCCC1(C(=O)NC(=O)N1)c2c3
SMILES	CACTVS	3.341	Fc1ccc2OCC[C]3(NC(=O)NC3=O)c2c1
SMILES	OpenEye OEToolkits	1.5.0	c1cc2c(cc1F)C3(CCO2)C(=O)NC(=O)N3
Canonical SMILES	CACTVS	3.341	Fc1ccc2OCC[C@]3(NC(=O)NC3=O)c2c1
Canonical SMILES	OpenEye OEToolkits	1.5.0	c1cc2c(cc1F)[C@@]3(CCO2)C(=O)NC(=O)N3
InChI	InChI	1.03	InChI=1S/C11H9FN2O3/c12-6-1-2-8-7(5-6)11(3-4-17-8)9(15)13-10(16)14-11/h1-2,5H,3-4H2,(H2,13,14,15,16)/t11-/m0/s1
InChIKey	InChI	1.03	LXANPKRCLVQAOG-NSHDSACASA-N

Drug Info: DrugBank

DrugBank ID	DB02712
Name	Sorbinil
Groups	experimental investigational
Synonyms	Sorbinil sorbinilo Sorbinilum
Categories	Aldehyde Reductase, antagonists & inhibitors Imidazoles
CAS number	68367-52-2

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
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