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CHEBI:209164 - Microsphaeropsin A

ChEBI IDCHEBI:209164
ChEBI NameMicrosphaeropsin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O4
Net Charge0
Average Mass266.337
Monoisotopic Mass266.15181
SMILESC=C1CO[C@H]2C=C3[C@@H](O)CC[C@@H](C)[C@]3(C)[C@H](O)[C@@]12O
InChIInChI=1S/C15H22O4/c1-8-4-5-11(16)10-6-12-15(18,9(2)7-19-12)13(17)14(8,10)3/h6,8,11-13,16-18H,2,4-5,7H2,1,3H3/t8-,11+,12+,13+,14+,15-/m1/s1
InChIKeyWSTNGTJRUMVECZ-UJLMXNMRSA-N
Species of MetaboliteComponentSourceComments
Microsphaeropsis (ncbitaxon:107453) - DOI (10.1002/ejoc.200700348)
ChEBI Ontology
Outgoing Relation(s)
Microsphaeropsin A (CHEBI:209164) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(3aS,4S,4aS,5R,8S,9aS)-4a,5-dimethyl-3-methylidene-4,5,6,7,8,9a-hexahydrobenzo[][1]benzouran-3a,4,8-triol
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78442621ChemSpider