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CHEBI:198075 - Biverlactone C

ChEBI IDCHEBI:198075
ChEBI NameBiverlactone C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H28O5
Net Charge0
Average Mass336.428
Monoisotopic Mass336.19367
SMILESCCCCCCC(C)/C=C(\C)[C@H](O)[C@H]1C=C(/C=C/C(=O)O)C(=O)O1
InChIInChI=1S/C19H28O5/c1-4-5-6-7-8-13(2)11-14(3)18(22)16-12-15(19(23)24-16)9-10-17(20)21/h9-13,16,18,22H,4-8H2,1-3H3,(H,20,21)/b10-9+,14-11+/t13?,16-,18+/m1/s1
InChIKeyJIEAIWBXHHLQAC-PSUWYRBNSA-N
Species of MetaboliteComponentSourceComments
Penicilliumspecies FKI-4429 (ncbitaxon:741178) - DOI (10.1016/j.tet.2011.05.061)
ChEBI Ontology
Outgoing Relation(s)
Biverlactone C (CHEBI:198075) is a aliphatic alcohol (CHEBI:2571)
IUPAC Name 
(E)-3-[(2R)-2-[(E,1S)-1-hydroxy-2,4-dimethyldec-2-enyl]-5-oxo-2H-uran-4-yl]prop-2-enoic acid
Manual XrefsDatabases
78436316ChemSpider