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CHEBI:188645 - 3-(2,6-Dibutylbenzyl)-1-[(4-methylphenyl)sulfonyl]-1H-indole

ChEBI IDCHEBI:188645
ChEBI Name3-(2,6-Dibutylbenzyl)-1-[(4-methylphenyl)sulfonyl]-1H-indole
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC30H35NO2S
Net Charge0
Average Mass473.682
Monoisotopic Mass473.23885
SMILESCCCCc1cccc(CCCC)c1Cc1cn(S(=O)(=O)c2ccc(C)cc2)c2ccccc12
InChIInChI=1S/C30H35NO2S/c1-4-6-11-24-13-10-14-25(12-7-5-2)29(24)21-26-22-31(30-16-9-8-15-28(26)30)34(32,33)27-19-17-23(3)18-20-27/h8-10,13-20,22H,4-7,11-12,21H2,1-3H3
InChIKeyHWOSGDBWXPFWHN-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
3-(2,6-Dibutylbenzyl)-1-[(4-methylphenyl)sulfonyl]-1H-indole (CHEBI:188645) is a sulfonamide (CHEBI:35358)
IUPAC Name 
3-[(2,6-dibutylphenyl)methyl]-1-(4-methylphenyl)sulonylindole
Manual XrefsDatabases
65326504ChemSpider