CHEBI:9543 - thienodolin

ChEBI IDCHEBI:9543
ChEBI Namethienodolin
Stars
DefinitionAn indole alkaloid that is a thienoindole ring with carboxamide group and chlorine substituents at positions 2 and 6 respectively.
Last Modified28 July 2014
DownloadsMolfile
FormulaC11H7ClN2OS
Net Charge0
Average Mass250.710
Monoisotopic Mass249.99676
SMILESNC(=O)c1cc2c(nc3cc(Cl)ccc32)s1
InChIInChI=1S/C11H7ClN2OS/c12-5-1-2-6-7-4-9(10(13)15)16-11(7)14-8(6)3-5/h1-4,14H,(H2,13,15)
InChIKeyLREDECYEGMWOAR-UHFFFAOYSA-N
Roles Classification
Biological Roles:
EC 1.14.13.39 (nitric oxide synthase) inhibitor  An EC 1.14.13.* (oxidoreductase acting on paired donors, incorporating 1 atom of oxygen, with NADH or NADPH as one donor) inhibitor that interferes with the action of nitric oxide synthase (EC 1.14.13.39).
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
thienodolin (CHEBI:9543) has role EC 1.14.13.39 (nitric oxide synthase) inhibitor (CHEBI:61908)
thienodolin (CHEBI:9543) is a aromatic amide (CHEBI:62733)
thienodolin (CHEBI:9543) is a indole alkaloid (CHEBI:38958)
thienodolin (CHEBI:9543) is a monocarboxylic acid amide (CHEBI:29347)
thienodolin (CHEBI:9543) is a organic heterotricyclic compound (CHEBI:26979)
thienodolin (CHEBI:9543) is a organochlorine compound (CHEBI:36683)
thienodolin (CHEBI:9543) is a organosulfur heterocyclic compound (CHEBI:38106)
IUPAC Name 
6-chloro-8H-thieno[2,3-b]indole-2-carboxamide
Manual XrefsDatabases
C09245KEGG COMPOUND
C00001775KNApSAcK
Registry NumbersSources
Reaxys:6370435Reaxys
CAS:149127-27-5KEGG COMPOUND
Citations