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CHEBI:225767 - Austalide X

ChEBI IDCHEBI:225767
ChEBI NameAustalide X
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SubmitterMetaboLights
DownloadsMolfile
FormulaC26H34O6
Net Charge0
Average Mass442.552
Monoisotopic Mass442.23554
SMILESC=C(C)[C@@H]1CC[C@]2(C)Oc3c(C)c4c(c(OC)c3C[C@@H]2[C@@]1(C)CCC(=O)OC)C(=O)OC4
InChIInChI=1S/C26H34O6/c1-14(2)18-8-11-26(5)19(25(18,4)10-9-20(27)29-6)12-16-22(32-26)15(3)17-13-31-24(28)21(17)23(16)30-7/h18-19H,1,8-13H2,2-7H3/t18-,19+,25-,26-/m0/s1
InChIKeyKWMGVLCRWUBGGX-ORSSICPCSA-N
Species of MetaboliteComponentSourceComments
Penicillium rudallense (ncbitaxon:1562030) - PubMed (31710223)
ChEBI Ontology
Outgoing Relation(s)
Austalide X (CHEBI:225767) is a xanthenes (CHEBI:38835)
IUPAC Name 
methyl 3-[(5aS,8S,9S,9aR)-11-methoxy-4,5a,9-trimethyl-1-oxo-8-prop-1-en-2-yl-3,6,7,8,9a,10-hexahydro-[2]benzouro[5,6-b]chromen-9-yl]propanoate
Manual XrefsDatabases
81361080ChemSpider