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CHEBI:199587 - Annullatin D

ChEBI IDCHEBI:199587
ChEBI NameAnnullatin D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H22O4
Net Charge0
Average Mass290.359
Monoisotopic Mass290.15181
SMILESCCCC[C@@H]1OC(=O)c2c1ccc1c2O[C@@H](C(C)(C)O)C1
InChIInChI=1S/C17H22O4/c1-4-5-6-12-11-8-7-10-9-13(17(2,3)19)21-15(10)14(11)16(18)20-12/h7-8,12-13,19H,4-6,9H2,1-3H3/t12-,13+/m0/s1
InChIKeyPVNMYTXDEUELFI-QWHCGFSZSA-N
Species of MetaboliteComponentSourceComments
Cordyceps (ncbitaxon:45234) - DOI (10.1016/j.tetlet.2012.02.088)
ChEBI Ontology
Outgoing Relation(s)
Annullatin D (CHEBI:199587) is a benzofurans (CHEBI:35259)
IUPAC Name 
(2R,6S)-6-butyl-2-(2-hydroxypropan-2-yl)-3,6-dihydro-2H-uro[3,4-g][1]benzouran-8-one
Manual XrefsDatabases
78436514ChemSpider