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CHEBI:233224 - AC-93253 iodide

ChEBI IDCHEBI:233224
ChEBI NameAC-93253 iodide
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SubmitterFlyBase
DownloadsMolfile
FormulaC23H25N2S.I
Net Charge0
Average Mass488.438
Monoisotopic Mass488.07832
SMILESCCN1/C(=C\C=C\C2=[N+](C)c3ccccc3C2(C)C)Sc2ccccc21.[I-]
InChIInChI=1S/C23H25N2S.HI/c1-5-25-19-13-8-9-14-20(19)26-22(25)16-10-15-21-23(2,3)17-11-6-7-12-18(17)24(21)4;/h6-16H,5H2,1-4H3;1H/q+1;/p-1
InChIKeyTWBRXRGFFUATNI-UHFFFAOYSA-M
Roles Classification
Biological Role:
EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor  An EC 2.3.* (acyltransferase) inhibitor that inhibits the action of any acyltransferase transferring groups other than amino-acyl groups (EC 2.3.1.*).
ChEBI Ontology
Outgoing Relation(s)
AC-93253 iodide (CHEBI:233224) has role EC 2.3.1.* (acyltransferase transferring other than amino-acyl group) inhibitor (CHEBI:76878)
AC-93253 iodide (CHEBI:233224) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
3-ethyl-2-[(E,3E)-3-(1,3,3-trimethylindol-2-ylidene)prop-1-enyl]-1,3-benzothiazol-3-ium;iodide
Synonym  Source
Benzothiazolium, 2-[3-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1-propen-1-yl]-3-ethyl-, iodideSUBMITTER
Registry NumbersSources
CAS:108527-83-9SUBMITTER