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CHEBI:208890 - Stereumin C

ChEBI IDCHEBI:208890
ChEBI NameStereumin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22O4
Net Charge0
Average Mass278.348
Monoisotopic Mass278.15181
SMILESC=C1[C@H](OC)O[C@H]2C(C)=CC[C@@H]3[C@@H]2C1(O)C(=O)C[C@H]3C
InChIInChI=1S/C16H22O4/c1-8-5-6-11-9(2)7-12(17)16(18)10(3)15(19-4)20-14(8)13(11)16/h5,9,11,13-15,18H,3,6-7H2,1-2,4H3/t9-,11+,13+,14+,15-,16?/m1/s1
InChIKeyUXFPPZJZYMHBTF-YQHBSZIESA-N
Species of MetaboliteComponentSourceComments
Stereum (ncbitaxon:5644) - PubMed (18325552)
ChEBI Ontology
Outgoing Relation(s)
Stereumin C (CHEBI:208890) is a oxanes (CHEBI:46942)
IUPAC Name 
(1R,3R,8R,9S,13S)-5-hydroxy-3-methoxy-8,12-dimethyl-4-methylidene-2-oxatricyclo[7.3.1.05,13]tridec-11-en-6-one