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CHEBI:217240 - Clostyrylpyrone A

Default Structure
ChEBI IDCHEBI:217240
ChEBI NameClostyrylpyrone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H12O7
Net Charge0
Average Mass316.265
Monoisotopic Mass316.05830
SMILESC[C@H]1OC(=O)c2c1cc(=O)oc2C=Cc1cc(O)c(O)c(O)c1
InChIInChI=1S/C16H12O7/c1-7-9-6-13(19)23-12(14(9)16(21)22-7)3-2-8-4-10(17)15(20)11(18)5-8/h2-7,17-18,20H,1H3/t7-/m1/s1
InChIKeyTWZDSYICEWNWBD-SSDOTTSWSA-N
Species of MetaboliteComponentSourceComments
Clostridium (ncbitaxon:1485) - PubMed (33052676)
ChEBI Ontology
Outgoing Relation(s)
Clostyrylpyrone A (CHEBI:217240) is a benzenetriol (CHEBI:22707)
IUPAC Name 
(1R)-1-methyl-4-[2-(3,4,5-trihydroxyphenyl)ethenyl]-1H-uro[3,4-c]pyran-3,6-dione