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CHEBI:207199 - Mevashuntin

ChEBI IDCHEBI:207199
ChEBI NameMevashuntin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H23NO7S
Net Charge0
Average Mass445.493
Monoisotopic Mass445.11952
SMILESCC(C)CCC1OC(CC(=O)O)Cc2cc3c(c(O)c21)C(=O)c1sc(=O)n(C)c1C3=O
InChIInChI=1S/C22H23NO7S/c1-9(2)4-5-13-15-10(6-11(30-13)8-14(24)25)7-12-16(19(15)27)20(28)21-17(18(12)26)23(3)22(29)31-21/h7,9,11,13,27H,4-6,8H2,1-3H3,(H,24,25)
InChIKeyVELDCVOCBUIETA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces prunicolor (ncbitaxon:67348) - DOI (10.1016/j.tetlet.2004.12.134)
ChEBI Ontology
Outgoing Relation(s)
Mevashuntin (CHEBI:207199) is a quinone (CHEBI:36141)
IUPAC Name 
2-[5-hydroxy-1-methyl-6-(3-methylbutyl)-2,4,11-trioxo-8,9-dihydro-6H-isochromeno[6,7-][1,3]benzothiazol-8-yl]acetic acid
Manual XrefsDatabases
31000751ChemSpider