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CHEBI:214358 - Kalkipyrone B

ChEBI IDCHEBI:214358
ChEBI NameKalkipyrone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O4
Net Charge0
Average Mass334.456
Monoisotopic Mass334.21441
SMILESCOc1oc(C/C=C(\C)CCC/C(C)=C/[C@@H](C)O)c(C)c(=O)c1C
InChIInChI=1S/C20H30O4/c1-13(8-7-9-14(2)12-15(3)21)10-11-18-16(4)19(22)17(5)20(23-6)24-18/h10,12,15,21H,7-9,11H2,1-6H3/b13-10+,14-12+/t15-/m1/s1
InChIKeyPOWDQNOFNJBGFS-FEFCGZSXSA-N
Species of MetaboliteComponentSourceComments
Leptolyngbyaspecies (ncbitaxon:47254) - PubMed (26632528)
ChEBI Ontology
Outgoing Relation(s)
Kalkipyrone B (CHEBI:214358) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
2-[(2E,7E,9R)-9-hydroxy-3,7-dimethyldeca-2,7-dienyl]-6-methoxy-3,5-dimethylpyran-4-one
Manual XrefsDatabases
58197292ChemSpider