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CHEBI:205999 - Melithiazol E

ChEBI IDCHEBI:205999
ChEBI NameMelithiazol E
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26N2O4S2
Net Charge0
Average Mass422.572
Monoisotopic Mass422.13340
SMILESCOC(=O)/C=C(/OC)C(C)C(/C=C/c1csc(-c2csc(C(C)C)n2)n1)OC
InChIInChI=1S/C20H26N2O4S2/c1-12(2)19-22-15(11-28-19)20-21-14(10-27-20)7-8-16(24-4)13(3)17(25-5)9-18(23)26-6/h7-13,16H,1-6H3/b8-7+,17-9+
InChIKeyLRTJMINIVSPVMX-ITDUAQOSSA-N
Species of MetaboliteComponentSourceComments
Melittangium lichenicola (ncbitaxon:45) - PubMed (10580385)
ChEBI Ontology
Outgoing Relation(s)
Melithiazol E (CHEBI:205999) is a thiazoles (CHEBI:48901)
IUPAC Name 
methyl (2E,6E)-3,5-dimethoxy-4-methyl-7-[2-(2-propan-2-yl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]hepta-2,6-dienoate
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8085798ChemSpider