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CHEBI:218570 - Arthrinone

ChEBI IDCHEBI:218570
ChEBI NameArthrinone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H12O7
Net Charge0
Average Mass280.232
Monoisotopic Mass280.05830
SMILESCOc1cc(O)c2c(c1)[C@@H](O)[C@@]13CO[C@@H](O)[C@@]1(O3)C2=O
InChIInChI=1S/C13H12O7/c1-18-5-2-6-8(7(14)3-5)10(16)13-11(17)19-4-12(13,20-13)9(6)15/h2-3,9,11,14-15,17H,4H2,1H3/t9-,11-,12+,13+/m1/s1
InChIKeyOACKXIAQYYDGIK-XEZLXBQYSA-N
Species of MetaboliteComponentSourceComments
Arthrinium (ncbitaxon:112177) - DOI (10.1021/np50114a006)
ChEBI Ontology
Outgoing Relation(s)
Arthrinone (CHEBI:218570) is a naphthofuran (CHEBI:39270)
IUPAC Name 
(1R,9R,10S,13R)-4,9,13-trihydroxy-6-methoxy-12,14-dioxatetracyclo[8.3.1.01,10.03,8]tetradeca-3(8),4,6-trien-2-one
Manual XrefsDatabases
8621781ChemSpider