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CHEBI:215159 - Ganocasuarinone A

ChEBI IDCHEBI:215159
ChEBI NameGanocasuarinone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H32O5
Net Charge0
Average Mass400.515
Monoisotopic Mass400.22497
SMILESCC(=O)[C@H]1C[C@H](O)[C@]2(C)[C@]1(C)C(=O)C=C1[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3C[C@H]3O[C@@]132
InChIInChI=1S/C24H32O5/c1-12(25)13-9-18(28)23(6)22(13,5)17(27)10-15-21(4)8-7-16(26)20(2,3)14(21)11-19-24(15,23)29-19/h10,13-14,18-19,28H,7-9,11H2,1-6H3/t13-,14+,18+,19-,21+,22+,23-,24+/m1/s1
InChIKeyAGSYOZCRYSLYLA-KEYGPGBISA-N
Species of MetaboliteComponentSourceComments
Ganoderma casuarinicola (ncbitaxon:2057914) - PubMed (31855780)
ChEBI Ontology
Outgoing Relation(s)
Ganocasuarinone A (CHEBI:215159) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,3R,5R,10S,14R,15S,17S,18S)-15-acetyl-17-hydroxy-6,6,10,14,18-pentamethyl-2-oxapentacyclo[9.7.0.01,3.05,10.014,18]octadec-11-ene-7,13-dione