loading...| Preferred Name |
sorbinil |
| Synonyms |
(S)-6-Fluorospiro(chroman-4,4'-imidazolidine)-2',5'-dione sorbinilo sorbinil sorbinol (4S)-6-fluoro-2,3-dihydro-2'H,5'H-spiro[chromene-4,4'-imidazolidine]-2',5'-dione sorbinilum |
| Definitions |
An azaspiro compound having a monofluoro-substituted chromane skeleton spiro-linked to an imidazolidinedione ring. |
| ID |
http://purl.obolibrary.org/obo/CHEBI_102029 |
| charge |
0 |
| database_cross_reference |
PDBeChem:SBI PMID:9349546 PMID:20354121 PMID:10933817 PMID:9088040 PMID:29438107 Patent:DE2821966 PMID:18772236 PMID:9195881 DrugBank:DB02712 PMID:9007520 PMID:19821053 Reaxys:4297401 PMID:20138035 PMID:7591626 PMID:11048957 Patent:US4130714 PMID:8159110 PMID:20308528 PMID:11900277 PMID:7564101 PMID:21129963 CAS:68367-52-2 PMID:10875546 PMID:8692029 Wikipedia:Sorbinil |
| definition |
An azaspiro compound having a monofluoro-substituted chromane skeleton spiro-linked to an imidazolidinedione ring. |
| formula |
C11H9FN2O3 |
| has role | |
| has_alternative_id |
CHEBI:45392 |
| has_exact_synonym |
(4S)-6-fluoro-2,3-dihydro-2'H,5'H-spiro[chromene-4,4'-imidazolidine]-2',5'-dione |
| has_obo_namespace |
chebi_ontology |
| has_related_synonym |
(S)-6-Fluorospiro(chroman-4,4'-imidazolidine)-2',5'-dione sorbinilo sorbinil sorbinol sorbinilum |
| id |
CHEBI:102029 |
| in_subset | |
| inchi |
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 |
LXANPKRCLVQAOG-NSHDSACASA-N |
| label |
sorbinil |
| mass |
236.19920 |
| monoisotopicmass |
236.060 |
| notation |
CHEBI:102029 |
| prefLabel |
sorbinil |
| smiles |
Fc1ccc2OCC[C@]3(NC(=O)NC3=O)c2c1 |
| treeView |
http://purl.obolibrary.org/obo/CHEBI_23230 http://purl.obolibrary.org/obo/CHEBI_37948 http://purl.obolibrary.org/obo/CHEBI_35624 |
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_23230 http://purl.obolibrary.org/obo/CHEBI_37948 http://purl.obolibrary.org/obo/CHEBI_35624 |
| Delete | Mapping To | Ontology | Source |
|---|---|---|---|
| http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C97357 | National Cancer Institute Thesaurus | LOOM | |
| http://purl.bioontology.org/ontology/MESH/C026411 | Medical Subject Headings | LOOM |