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CHEBI:206350 - Spiroapplanatumine O

ChEBI IDCHEBI:206350
ChEBI NameSpiroapplanatumine O
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H16O6
Net Charge0
Average Mass316.309
Monoisotopic Mass316.09469
SMILESC=C(C=O)[C@@H]1CC[C@@H](C(=O)OC)[C@]12Oc1ccc(O)cc1C2=O
InChIInChI=1S/C17H16O6/c1-9(8-18)12-4-5-13(16(21)22-2)17(12)15(20)11-7-10(19)3-6-14(11)23-17/h3,6-8,12-13,19H,1,4-5H2,2H3/t12-,13-,17+/m0/s1
InChIKeyXHAIZAIMQFIIRF-GDZNZVCISA-N
Species of MetaboliteComponentSourceComments
Ganoderma applanatum (ncbitaxon:29884) - PubMed (27996259)
ChEBI Ontology
Outgoing Relation(s)
Spiroapplanatumine O (CHEBI:206350) is a benzofurans (CHEBI:35259)
IUPAC Name 
methyl (1'R,2R,3'S)-5-hydroxy-3-oxo-3'-(3-oxoprop-1-en-2-yl)spiro[1-benzouran-2,2'-cyclopentane]-1'-carboxylate
Manual XrefsDatabases
78441629ChemSpider