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CHEBI:205015 - BCA 4

ChEBI IDCHEBI:205015
ChEBI NameBCA 4
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SubmitterMetaboLights
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FormulaC22H34O4
Net Charge0
Average Mass362.510
Monoisotopic Mass362.24571
SMILESCOC1CCC(=O)C(CC2C(C(C)CCC=C(C)C)=CCC2(C)O)=C1O
InChIInChI=1S/C22H34O4/c1-14(2)7-6-8-15(3)16-11-12-22(4,25)18(16)13-17-19(23)9-10-20(26-5)21(17)24/h7,11,15,18,20,24-25H,6,8-10,12-13H2,1-5H3
InChIKeyHZYZCUHNMRNNIT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Alternaria alternata (ncbitaxon:5599) - DOI (10.1016/s0031-9422(00)00268-5)
ChEBI Ontology
Outgoing Relation(s)
BCA 4 (CHEBI:205015) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
3-hydroxy-2-[[5-hydroxy-5-methyl-2-(6-methylhept-5-en-2-yl)cyclopent-2-en-1-yl]methyl]-4-methoxycyclohex-2-en-1-one
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78444094ChemSpider