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CHEBI:217520 - Xeromphalinone F

ChEBI IDCHEBI:217520
ChEBI NameXeromphalinone F
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SubmitterMetaboLights
DownloadsMolfile
FormulaC29H36O6
Net Charge0
Average Mass480.601
Monoisotopic Mass480.25119
SMILESC=C1C(=O)[C@H]2O[C@]23C[C@H]2CC(C)(C)C[C@H]2[C@]13C(=O)OCC1=C2[C@@H]3CC(C)(C)C[C@@H]3C[C@@]2(O)CC1=O
InChIInChI=1S/C29H36O6/c1-14-22(31)23-28(35-23)9-16-7-26(4,5)11-19(16)29(14,28)24(32)34-13-18-20(30)12-27(33)8-15-6-25(2,3)10-17(15)21(18)27/h15-17,19,23,33H,1,6-13H2,2-5H3/t15-,16-,17-,19-,23-,27-,28-,29+/m1/s1
InChIKeyPBSWJQCHCOJAFD-WZMYRWFZSA-N
Species of MetaboliteComponentSourceComments
Xeromphalinaspecies (ncbitaxon:2011762) - PubMed (20345148)
ChEBI Ontology
Outgoing Relation(s)
Xeromphalinone F (CHEBI:217520) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
[(3bR,6aR,7aR)-7a-hydroxy-5,5-dimethyl-2-oxo-1,3b,4,6,6a,7-hexahydrocyclopenta[a]pentalen-3-yl]methyl (1S,3R,7R,8S,11S)-5,5-dimethyl-9-methylidene-10-oxo-12-oxatetracyclo[6.4.0.01,11.03,7]dodecane-8-carboxylate
Manual XrefsDatabases
25933105ChemSpider