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CHEBI:216982 - Graphostrin B

ChEBI IDCHEBI:216982
ChEBI NameGraphostrin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H16O5
Net Charge0
Average Mass240.255
Monoisotopic Mass240.09977
SMILESC[C@H](O)[C@H](O)CCC(=O)c1ccc(O)cc1O
InChIInChI=1S/C12H16O5/c1-7(13)10(15)4-5-11(16)9-3-2-8(14)6-12(9)17/h2-3,6-7,10,13-15,17H,4-5H2,1H3/t7-,10+/m0/s1
InChIKeyZMNGSXUKJPQMSL-OIBJUYFYSA-N
Species of MetaboliteComponentSourceComments
Graphostroma (ncbitaxon:190933) - PubMed (29355320)
ChEBI Ontology
Outgoing Relation(s)
Graphostrin B (CHEBI:216982) is a aromatic ketone (CHEBI:76224)
IUPAC Name 
(4R,5S)-1-(2,4-dihydroxyphenyl)-4,5-dihydroxyhexan-1-one
Manual XrefsDatabases
65323342ChemSpider