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CHEBI:184398 - SCHEMBL14863920

ChEBI IDCHEBI:184398
ChEBI NameSCHEMBL14863920
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H33N3O7S
Net Charge0
Average Mass591.686
Monoisotopic Mass591.20392
SMILESCOc1cc(C(=O)NS(=O)(=O)c2ccccc2C)ccc1Cc1cn(CO)c2ccc(NC(=O)OC3CCCC3)cc12
InChIInChI=1S/C31H33N3O7S/c1-20-7-3-6-10-29(20)42(38,39)33-30(36)22-12-11-21(28(16-22)40-2)15-23-18-34(19-35)27-14-13-24(17-26(23)27)32-31(37)41-25-8-4-5-9-25/h3,6-7,10-14,16-18,25,35H,4-5,8-9,15,19H2,1-2H3,(H,32,37)(H,33,36)
InChIKeyHZAQOSFFIGVMDH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Bos taurus (ncbitaxon:9913) spermatozoon (BTO:0001277) MetaboLights (MTBLS1071) Strain: Holstein [LBO:0000132]
ChEBI Ontology
Outgoing Relation(s)
SCHEMBL14863920 (CHEBI:184398) is a sulfonamide (CHEBI:35358)
IUPAC Name 
cyclopentyl N-[1-(hydroxymethyl)-3-[[2-methoxy-4-[(2-methylphenyl)sulonylcarbamoyl]phenyl]methyl]indol-5-yl]carbamate
Manual XrefsDatabases
30778614ChemSpider
HMDB0060986HMDB