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CHEBI:198320 - Sphaerolabdadiene-3,14-diol

ChEBI IDCHEBI:198320
ChEBI NameSphaerolabdadiene-3,14-diol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H33BrO2
Net Charge0
Average Mass385.386
Monoisotopic Mass384.16639
SMILESC=CC(C)(O)CCC1C(C)=CCC(Br)C1(C)CCC(O)C(=C)C
InChIInChI=1S/C20H33BrO2/c1-7-19(5,23)12-10-16-15(4)8-9-18(21)20(16,6)13-11-17(22)14(2)3/h7-8,16-18,22-23H,1-2,9-13H2,3-6H3
InChIKeyUXNHALFPXFVTMG-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Staphylococcus aureus (ncbitaxon:1280) - PubMed (11520219)
ChEBI Ontology
Outgoing Relation(s)
Sphaerolabdadiene-3,14-diol (CHEBI:198320) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
5-[6-bromo-2-(3-hydroxy-3-methylpent-4-enyl)-1,3-dimethylcyclohex-3-en-1-yl]-2-methylpent-1-en-3-ol
Manual XrefsDatabases
10478613ChemSpider