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CHEBI:198149 - Paecilomycine B

ChEBI IDCHEBI:198149
ChEBI NamePaecilomycine B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O5
Net Charge0
Average Mass282.336
Monoisotopic Mass282.14672
SMILESCC1=C[C@@H]2OC[C@]3(O)[C@H](O)[C@@]4(O)C[C@]3(C)[C@]2(CC1)CO4
InChIInChI=1S/C15H22O5/c1-9-3-4-13-7-20-15(18)6-12(13,2)14(17,11(15)16)8-19-10(13)5-9/h5,10-11,16-18H,3-4,6-8H2,1-2H3/t10-,11-,12+,13+,14-,15+/m0/s1
InChIKeyJQCNBKRASCMEBM-JRULLXGZSA-N
Species of MetaboliteComponentSourceComments
Cordyceps tenuipes (ncbitaxon:45847) - DOI (10.1016/j.tetlet.2004.06.107)
ChEBI Ontology
Outgoing Relation(s)
Paecilomycine B (CHEBI:198149) is a oxacycle (CHEBI:38104)
IUPAC Name 
(1R,4R,9S,12S,13R,15S)-7,13-dimethyl-2,10-dioxatetracyclo[10.2.1.04,9.04,13]pentadec-7-ene-1,12,15-triol
Manual XrefsDatabases
9532939ChemSpider