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CHEBI:212081 - Arthropsadiol B

ChEBI IDCHEBI:212081
ChEBI NameArthropsadiol B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O4
Net Charge0
Average Mass224.256
Monoisotopic Mass224.10486
SMILESC/C=C/[C@H]1C=CC(=O)[C@H](O)[C@H]1C(=O)C(C)O
InChIInChI=1S/C12H16O4/c1-3-4-8-5-6-9(14)12(16)10(8)11(15)7(2)13/h3-8,10,12-13,16H,1-2H3/b4-3+/t7?,8-,10+,12-/m0/s1
InChIKeyHVMKQUCBQJNJSQ-LYLXNWQCSA-N
Species of MetaboliteComponentSourceComments
Arthropsis (ncbitaxon:1213591) - DOI (10.1139/v92-172)
ChEBI Ontology
Outgoing Relation(s)
Arthropsadiol B (CHEBI:212081) is a cyclohexenones (CHEBI:48953)
IUPAC Name 
(4S,5S,6R)-6-hydroxy-5-(2-hydroxypropanoyl)-4-[(E)-prop-1-enyl]cyclohex-2-en-1-one
Manual XrefsDatabases
78437997ChemSpider