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CHEBI:213229 - Chaephilone C

ChEBI IDCHEBI:213229
ChEBI NameChaephilone C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC23H27ClO7
Net Charge0
Average Mass450.915
Monoisotopic Mass450.14453
SMILESCC[C@H](C)/C=C/C1=CC2=C(Cl)C(=O)[C@@](C)(O)[C@H]3C4=C(O[C@]23[C@@H](O)O1)[C@@H](C)[C@@H](C)OC4=O
InChIInChI=1S/C23H27ClO7/c1-6-10(2)7-8-13-9-14-16(24)19(25)22(5,28)18-15-17(11(3)12(4)29-20(15)26)31-23(14,18)21(27)30-13/h7-12,18,21,27-28H,6H2,1-5H3/b8-7+/t10-,11-,12+,18+,21-,22-,23+/m0/s1
InChIKeyDRXHCNPRWVOWLR-MGYQDICESA-N
Species of MetaboliteComponentSourceComments
Chaetomium (ncbitaxon:5149) - PubMed (29438326)
ChEBI Ontology
Outgoing Relation(s)
Chaephilone C (CHEBI:213229) is a pyranone (CHEBI:37963)
IUPAC Name 
(1S,2S,9S,10R,14R,15S)-7-chloro-2,9-dihydroxy-9,14,15-trimethyl-4-[(E,3S)-3-methylpent-1-enyl]-3,13,17-trioxatetracyclo[8.7.0.01,6.011,16]heptadeca-4,6,11(16)-triene-8,12-dione
Manual XrefsDatabases
64868948ChemSpider