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CHEBI:207105 - Chartarene B

ChEBI IDCHEBI:207105
ChEBI NameChartarene B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H26O4
Net Charge0
Average Mass282.380
Monoisotopic Mass282.18311
SMILESCO[C@H]1C[C@@H](O)[C@]2(C)[C@@]3(C)CCC(C)=C[C@H]3O[C@]12CO
InChIInChI=1S/C16H26O4/c1-10-5-6-14(2)12(7-10)20-16(9-17)13(19-4)8-11(18)15(14,16)3/h7,11-13,17-18H,5-6,8-9H2,1-4H3/t11-,12-,13+,14+,15-,16-/m1/s1
InChIKeyHUOIYUNHZSQGOK-OWDFPOFWSA-N
Species of MetaboliteComponentSourceComments
Stachybotrys chartarum (ncbitaxon:74722) - DOI (10.1039/c6ra26956g)
ChEBI Ontology
Outgoing Relation(s)
Chartarene B (CHEBI:207105) is a oxolanes (CHEBI:26912)
IUPAC Name 
(1R,3S,3aR,4aR,8aR,8bS)-3a-(hydroxymethyl)-3-methoxy-6,8a,8b-trimethyl-1,2,3,4a,7,8-hexahydrocyclopenta[b][1]benzouran-1-ol
Manual XrefsDatabases
61708718ChemSpider