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CHEBI:197556 - Melithiazol B

ChEBI IDCHEBI:197556
ChEBI NameMelithiazol B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H24N2O4S2
Net Charge0
Average Mass420.556
Monoisotopic Mass420.11775
SMILESC=C(C)c1nc(-c2nc(/C=C/C(OC)C(C)/C(=C\C(=O)OC)OC)cs2)cs1
InChIInChI=1S/C20H24N2O4S2/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/h7-11,13,16H,1H2,2-6H3/b8-7+,17-9+
InChIKeyMIUFOGFASQSNPX-ITDUAQOSSA-N
Species of MetaboliteComponentSourceComments
Melittangium (ncbitaxon:44) - PubMed (10580385)
ChEBI Ontology
Outgoing Relation(s)
Melithiazol B (CHEBI:197556) is a thiazoles (CHEBI:48901)
IUPAC Name 
methyl (2E,6E)-3,5-dimethoxy-4-methyl-7-[2-(2-prop-1-en-2-yl-1,3-thiazol-4-yl)-1,3-thiazol-4-yl]hepta-2,6-dienoate
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9011223ChemSpider