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CHEBI:217683 - JBIR-24

ChEBI IDCHEBI:217683
ChEBI NameJBIR-24
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24O7
Net Charge0
Average Mass388.416
Monoisotopic Mass388.15220
SMILESCOC(=C\C(C)=C\[C@@H]1CCC[C@]2(O)O[C@@H]3C(=CC(=O)[C@@H]4O[C@H]34)[C@@H]12)/C=C/C(=O)O
InChIInChI=1S/C21H24O7/c1-11(9-13(26-2)5-6-16(23)24)8-12-4-3-7-21(25)17(12)14-10-15(22)19-20(27-19)18(14)28-21/h5-6,8-10,12,17-20,25H,3-4,7H2,1-2H3,(H,23,24)/b6-5+,11-8+,13-9-/t12-,17+,18+,19-,20+,21-/m0/s1
InChIKeyZMORYXMUVFYWLG-WVINDXBQSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (19086885)
ChEBI Ontology
Outgoing Relation(s)
JBIR-24 (CHEBI:217683) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(2E,4Z,6E)-7-[(2R,3S,7S,9R,10R,12R)-7-hydroxy-13-oxo-8,11-dioxatetracyclo[7.5.0.02,7.010,12]tetradec-1(14)-en-3-yl]-4-methoxy-6-methylhepta-2,4,6-trienoic acid
Manual XrefsDatabases
78441933ChemSpider