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CHEBI:221720 - Humicolone

ChEBI IDCHEBI:221720
ChEBI NameHumicolone
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O4
Net Charge0
Average Mass220.224
Monoisotopic Mass220.07356
SMILESC[C@H]1Oc2cccc3c2[C@H](O1)[C@@H](O)CC3=O
InChIInChI=1S/C12H12O4/c1-6-15-10-4-2-3-7-8(13)5-9(14)12(16-6)11(7)10/h2-4,6,9,12,14H,5H2,1H3/t6-,9-,12+/m0/s1
InChIKeyZQTNASBNSCQZQC-ZKQGETEISA-N
Species of MetaboliteComponentSourceComments
Trichocladium griseum (ncbitaxon:2567926) - DOI (10.1016/s0040-4020(02)01222-x)
ChEBI Ontology
Outgoing Relation(s)
Humicolone (CHEBI:221720) is a tetralins (CHEBI:36786)
IUPAC Name 
(3R,5S,6S)-6-hydroxy-3-methyl-2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),9(13),10-trien-8-one
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9950306ChemSpider