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CHEBI:220835 - Pyripyropene O

ChEBI IDCHEBI:220835
ChEBI NamePyripyropene O
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H35NO7
Net Charge0
Average Mass509.599
Monoisotopic Mass509.24135
SMILESCC(=O)OC[C@@]1(C)[C@@H]2CC[C@@]3(C)Oc4cc(-c5cccnc5)oc(=O)c4C[C@@H]3[C@@]2(C)CC[C@@H]1OC(C)=O
InChIInChI=1S/C29H35NO7/c1-17(31)34-16-28(4)23-8-11-29(5)24(27(23,3)10-9-25(28)35-18(2)32)13-20-22(37-29)14-21(36-26(20)33)19-7-6-12-30-15-19/h6-7,12,14-15,23-25H,8-11,13,16H2,1-5H3/t23-,24-,25+,27+,28+,29-/m1/s1
InChIKeyLNZRIIIDRGIMHV-QXHZFDHFSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (8626247)
ChEBI Ontology
Outgoing Relation(s)
Pyripyropene O (CHEBI:220835) is a steroid (CHEBI:35341)
IUPAC Name 
[(1R,2S,5S,6R,7R,10R)-5-acetyloxy-2,6,10-trimethyl-16-oxo-14-pyridin-3-yl-11,15-dioxatetracyclo[8.8.0.02,7.012,17]octadeca-12(17),13-dien-6-yl]methyl acetate
Manual XrefsDatabases
8729104ChemSpider