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CHEBI:201064 - Chrysoarticulin B

ChEBI IDCHEBI:201064
ChEBI NameChrysoarticulin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H20O5
Net Charge0
Average Mass280.320
Monoisotopic Mass280.13107
SMILESCC[C@@H](C)[C@H]1OC(=O)c2c(O)c(CO)cc(C)c2[C@@H]1O
InChIInChI=1S/C15H20O5/c1-4-7(2)14-13(18)10-8(3)5-9(6-16)12(17)11(10)15(19)20-14/h5,7,13-14,16-18H,4,6H2,1-3H3/t7-,13+,14-/m1/s1
InChIKeyXDEVOPTVZKYJBE-IYCUSSIYSA-N
Species of MetaboliteComponentSourceComments
Chrysosporium articulatum (ncbitaxon:79083) - DOI (10.1016/j.tetlet.2013.04.006)
ChEBI Ontology
Outgoing Relation(s)
Chrysoarticulin B (CHEBI:201064) is a 2-benzopyran (CHEBI:38444)
IUPAC Name 
(3R,4S)-3-[(2R)-butan-2-yl]-4,8-dihydroxy-7-(hydroxymethyl)-5-methyl-3,4-dihydroisochromen-1-one
Manual XrefsDatabases
30770867ChemSpider