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CHEBI:227388 - BCA 11

ChEBI IDCHEBI:227388
ChEBI NameBCA 11
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SubmitterMetaboLights
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FormulaC22H36O5
Net Charge0
Average Mass380.525
Monoisotopic Mass380.25627
SMILESCOC1CCC(=O)C(CC2C(C(C)CCCC(C)CO)=CCC2(C)O)=C1O
InChIInChI=1S/C22H36O5/c1-14(13-23)6-5-7-15(2)16-10-11-22(3,26)18(16)12-17-19(24)8-9-20(27-4)21(17)25/h10,14-15,18,20,23,25-26H,5-9,11-13H2,1-4H3
InChIKeyCNCWASXFRPCBBE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Alternaria alternata (ncbitaxon:5599) - DOI (10.1016/s0031-9422(00)00268-5)
ChEBI Ontology
Outgoing Relation(s)
BCA 11 (CHEBI:227388) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
3-hydroxy-2-[[5-hydroxy-2-(7-hydroxy-6-methylheptan-2-yl)-5-methylcyclopent-2-en-1-yl]methyl]-4-methoxycyclohex-2-en-1-one
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