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CHEBI:197974 - Eutypellone A

ChEBI IDCHEBI:197974
ChEBI NameEutypellone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H30O4
Net Charge0
Average Mass334.456
Monoisotopic Mass334.21441
SMILESC=C[C@@]1(C)CCC2=C([C@@H](O)C(=O)[C@H]3C(C)(C)CC[C@@H](O)[C@]23C)[C@H]1O
InChIInChI=1S/C20H30O4/c1-6-19(4)10-7-11-13(17(19)24)14(22)15(23)16-18(2,3)9-8-12(21)20(11,16)5/h6,12,14,16-17,21-22,24H,1,7-10H2,2-5H3/t12-,14-,16+,17-,19+,20+/m1/s1
InChIKeyKKWFUTJLCATXQH-QTJPKYNYSA-N
Species of MetaboliteComponentSourceComments
Eutypella (ncbitaxon:140192) - PubMed (21881261)
ChEBI Ontology
Outgoing Relation(s)
Eutypellone A (CHEBI:197974) is a diterpenoid (CHEBI:23849)
IUPAC Name 
(1S,2R,4bS,5R,8aS,10R)-2-ethenyl-1,5,10-trihydroxy-2,4b,8,8-tetramethyl-1,3,4,5,6,7,8a,10-octahydrophenanthren-9-one
Manual XrefsDatabases
78436299ChemSpider