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CHEBI:199283 - Tricycloalternarene 11a

ChEBI IDCHEBI:199283
ChEBI NameTricycloalternarene 11a
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H34O4
Net Charge0
Average Mass362.510
Monoisotopic Mass362.24571
SMILESCOC1CCC(=O)C2=C1OC1(C)CC=C(C(C)CCCC(C)CO)C1C2
InChIInChI=1S/C22H34O4/c1-14(13-23)6-5-7-15(2)16-10-11-22(3)18(16)12-17-19(24)8-9-20(25-4)21(17)26-22/h10,14-15,18,20,23H,5-9,11-13H2,1-4H3
InChIKeyYQNSDWMPJRRXJM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Alternaria alternata (ncbitaxon:5599) - DOI (10.1016/s0031-9422(99)00275-7)
ChEBI Ontology
Outgoing Relation(s)
Tricycloalternarene 11a (CHEBI:199283) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
1-(7-hydroxy-6-methylheptan-2-yl)-5-methoxy-3a-methyl-3,5,6,7,9,9a-hexahydrocyclopenta[b]chromen-8-one
Manual XrefsDatabases
78443630ChemSpider