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CHEBI:205755 - Macrosporin-7-O-sulphate

ChEBI IDCHEBI:205755
ChEBI NameMacrosporin-7-O-sulphate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H12O8S
Net Charge0
Average Mass364.331
Monoisotopic Mass364.02529
SMILESCOc1cc(O)c2c(c1)C(=O)c1cc(C)c(OS(=O)(=O)O)cc1C2=O
InChIInChI=1S/C16H12O8S/c1-7-3-9-10(6-13(7)24-25(20,21)22)16(19)14-11(15(9)18)4-8(23-2)5-12(14)17/h3-6,17H,1-2H3,(H,20,21,22)
InChIKeyCITCDKZOBAZVCS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ampelomycesspecies (ncbitaxon:1935294) - PubMed (18400237)
ChEBI Ontology
Outgoing Relation(s)
Macrosporin-7-O-sulphate (CHEBI:205755) is a anthraquinone (CHEBI:22580)
IUPAC Name 
(8-hydroxy-6-methoxy-3-methyl-9,10-dioxoanthracen-2-yl) hydrogen sulate
Manual XrefsDatabases
58983130ChemSpider