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CHEBI:227284 - Auxarthrol C

ChEBI IDCHEBI:227284
ChEBI NameAuxarthrol C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H16O9
Net Charge0
Average Mass352.295
Monoisotopic Mass352.07943
SMILESCOc1cc(O)c2c(c1)C(=O)[C@@]13O[C@]1(C2=O)[C@H](O)[C@@H](O)[C@@](C)(O)[C@@H]3O
InChIInChI=1S/C16H16O9/c1-14(23)11(20)12(21)15-10(19)8-6(3-5(24-2)4-7(8)17)9(18)16(15,25-15)13(14)22/h3-4,11-13,17,20-23H,1-2H3/t11-,12-,13+,14-,15-,16+/m1/s1
InChIKeyIGQRNPSFVHAGKN-AQGHMYMLSA-N
Species of MetaboliteComponentSourceComments
Stemphyliumspecies 33231 (ncbitaxon:1418481) - PubMed (25136754)
ChEBI Ontology
Outgoing Relation(s)
Auxarthrol C (CHEBI:227284) is a hydroxyanthraquinones (CHEBI:37485)
IUPAC Name 
(1R,10S,11S,12R,13R,14R)-4,11,12,13,14-pentahydroxy-6-methoxy-12-methyl-15-oxatetracyclo[8.4.1.01,10.03,8]pentadeca-3(8),4,6-triene-2,9-dione
Manual XrefsDatabases
34981905ChemSpider