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CHEBI:214442 - Trichodermaketone E

ChEBI IDCHEBI:214442
ChEBI NameTrichodermaketone E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O5
Net Charge0
Average Mass296.363
Monoisotopic Mass296.16237
SMILESCCCCCC[C@@H]1O[C@@H]2C3=C(CC[C@@H](O)C3=O)O[C@@H]2[C@@H]1O
InChIInChI=1S/C16H24O5/c1-2-3-4-5-6-11-14(19)16-15(21-11)12-10(20-16)8-7-9(17)13(12)18/h9,11,14-17,19H,2-8H2,1H3/t9-,11+,14-,15-,16-/m1/s1
InChIKeyPDGBDTHQTORUCD-XDDVRUDJSA-N
Species of MetaboliteComponentSourceComments
Trichoderma (ncbitaxon:5543) - PubMed (32954632)
ChEBI Ontology
Outgoing Relation(s)
Trichodermaketone E (CHEBI:214442) is a furofuran (CHEBI:47790)
IUPAC Name 
(2S,3R,3aR,7R,8bR)-2-hexyl-3,7-dihydroxy-3,3a,5,6,7,8b-hexahydro-2H-uro[3,2-b][1]benzouran-8-one