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CHEBI:227826 - Stagonosporyne A

ChEBI IDCHEBI:227826
ChEBI NameStagonosporyne A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O3
Net Charge0
Average Mass196.246
Monoisotopic Mass196.10994
SMILESC=C(C)C#C[C@]1(O)C[C@@H](O)CC[C@@H]1O
InChIInChI=1S/C11H16O3/c1-8(2)5-6-11(14)7-9(12)3-4-10(11)13/h9-10,12-14H,1,3-4,7H2,2H3/t9-,10-,11-/m0/s1
InChIKeyYUVVZJWWPOAMSK-DCAQKATOSA-N
Species of MetaboliteComponentSourceComments
Parastagonospora nodorum SN15 (ncbitaxon:321614) - PubMed (31302342)
ChEBI Ontology
Outgoing Relation(s)
Stagonosporyne A (CHEBI:227826) is a cyclohexanols (CHEBI:23480)
IUPAC Name 
(1S,2R,4S)-2-(3-methylbut-3-en-1-ynyl)cyclohexane-1,2,4-triol