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CHEBI:199363 - (6E)-3,5-Dihydroxy-2,6-dimethyl-7-(2-methyl-1,3-thiazol-4-yl)-6-heptenoic acid

Default Structure
ChEBI IDCHEBI:199363
ChEBI Name(6E)-3,5-Dihydroxy-2,6-dimethyl-7-(2-methyl-1,3-thiazol-4-yl)-6-heptenoic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H19NO4S
Net Charge0
Average Mass285.365
Monoisotopic Mass285.10348
SMILESC/C(=C\c1csc(C)n1)C(O)CC(O)C(C)C(=O)O
InChIInChI=1S/C13H19NO4S/c1-7(4-10-6-19-9(3)14-10)11(15)5-12(16)8(2)13(17)18/h4,6,8,11-12,15-16H,5H2,1-3H3,(H,17,18)/b7-4+
InChIKeyDGVOKXGUGFTLRK-QPJJXVBHSA-N
Species of MetaboliteComponentSourceComments
Sorangium cellulosum (ncbitaxon:56) - PubMed (11473410)
ChEBI Ontology
Outgoing Relation(s)
(6E)-3,5-Dihydroxy-2,6-dimethyl-7-(2-methyl-1,3-thiazol-4-yl)-6-heptenoic acid (CHEBI:199363) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(E)-3,5-dihydroxy-2,6-dimethyl-7-(2-methyl-1,3-thiazol-4-yl)hept-6-enoic acid
Manual XrefsDatabases
9219501ChemSpider