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CHEBI:208017 - Trichdermanone C

ChEBI IDCHEBI:208017
ChEBI NameTrichdermanone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H26O8
Net Charge0
Average Mass394.420
Monoisotopic Mass394.16277
SMILESC/C=C/C=C/C(O)=C1/C(=O)[C@]2(C)C(=O)[C@@](C)(O)[C@H]1[C@]1(O)CO[C@](O)(CO)C[C@H]21
InChIInChI=1S/C20H26O8/c1-4-5-6-7-11(22)13-14-18(3,25)16(24)17(2,15(13)23)12-8-19(26,9-21)28-10-20(12,14)27/h4-7,12,14,21-22,25-27H,8-10H2,1-3H3/b5-4+,7-6+,13-11-/t12-,14+,17-,18+,19+,20+/m1/s1
InChIKeyCFELOEAQUHFCCH-ZOFLDUJOSA-N
Species of MetaboliteComponentSourceComments
Trichodermaspecies (ncbitaxon:1715253) - DOI (10.1002/ejoc.200601092)
ChEBI Ontology
Outgoing Relation(s)
Trichdermanone C (CHEBI:208017) is a oxanes (CHEBI:46942)
IUPAC Name 
(1R,2S,5S,7R,8R,10S,11Z)-2,5,10-trihydroxy-11-[(2E,4E)-1-hydroxyhexa-2,4-dienylidene]-5-(hydroxymethyl)-8,10-dimethyl-4-oxatricyclo[6.2.2.02,7]dodecane-9,12-dione
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17625176ChemSpider