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CHEBI:213589 - Microcarbonin A

ChEBI IDCHEBI:213589
ChEBI NameMicrocarbonin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC25H36O2
Net Charge0
Average Mass368.561
Monoisotopic Mass368.27153
SMILESCCCCCC#CC#Cc1cc(O)c(CCCCCCCCCC)c(O)c1
InChIInChI=1S/C25H36O2/c1-3-5-7-9-11-13-15-17-19-23-24(26)20-22(21-25(23)27)18-16-14-12-10-8-6-4-2/h20-21,26-27H,3-11,13,15,17,19H2,1-2H3
InChIKeySIKKSDHUYNQRBH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Microcystis (ncbitaxon:1125) - DOI (10.1560/fe24-vyuf-ctbd-hb7x)
ChEBI Ontology
Outgoing Relation(s)
Microcarbonin A (CHEBI:213589) is a resorcinols (CHEBI:33572)
IUPAC Name 
2-decyl-5-nona-1,3-diynylbenzene-1,3-diol
Manual XrefsDatabases
28591137ChemSpider