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CHEBI:224234 - Tricholomalide A

ChEBI IDCHEBI:224234
ChEBI NameTricholomalide A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28O5
Net Charge0
Average Mass348.439
Monoisotopic Mass348.19367
SMILESC=C1CO[C@H]2[C@@H]3C(=O)C[C@@H](C(C)C)[C@]3(C)C[C@H]3OC(=O)C[C@@]3(C)[C@@]12O
InChIInChI=1S/C20H28O5/c1-10(2)12-6-13(21)16-17-20(23,11(3)9-24-17)19(5)8-15(22)25-14(19)7-18(12,16)4/h10,12,14,16-17,23H,3,6-9H2,1-2,4-5H3/t12-,14+,16-,17-,18-,19+,20+/m0/s1
InChIKeyFNWXCFNQVRNNMR-AAQVCALCSA-N
Species of MetaboliteComponentSourceComments
Tricholomaspecies (ncbitaxon:1745201) - PubMed (14695800)
ChEBI Ontology
Outgoing Relation(s)
Tricholomalide A (CHEBI:224234) is a γ-lactone (CHEBI:37581)
IUPAC Name 
(1R,2S,6S,7R,11R,13S,14S)-6-hydroxy-7,13-dimethyl-5-methylidene-14-propan-2-yl-3,10-dioxatetracyclo[11.3.0.02,6.07,11]hexadecane-9,16-dione
Manual XrefsDatabases
9523553ChemSpider