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CHEBI:207955 - Pleurospiroketal C

ChEBI IDCHEBI:207955
ChEBI NamePleurospiroketal C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H24O7
Net Charge0
Average Mass340.372
Monoisotopic Mass340.15220
SMILESCC(=O)OCC1=C2CC[C@](C)(O)[C@H](O)[C@H]2O[C@@]12OC(C)(C)CC2=O
InChIInChI=1S/C17H24O7/c1-9(18)22-8-11-10-5-6-16(4,21)14(20)13(10)23-17(11)12(19)7-15(2,3)24-17/h13-14,20-21H,5-8H2,1-4H3/t13-,14+,16-,17+/m0/s1
InChIKeyFCTKYSFQSVQLKF-HDEZJCGLSA-N
Species of MetaboliteComponentSourceComments
Pleurotus cornucopiae (ncbitaxon:5321) - PubMed (23294419)
ChEBI Ontology
Outgoing Relation(s)
Pleurospiroketal C (CHEBI:207955) is a benzofurans (CHEBI:35259)
IUPAC Name 
[(2R,6S,7R,7aS)-6,7-dihydroxy-5',5',6-trimethyl-3'-oxospiro[4,5,7,7a-tetrahydro-1-benzouran-2,2'-oxolane]-3-yl]methyl acetate
Manual XrefsDatabases
29418460ChemSpider