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CHEBI:216974 - Graphostrin A

ChEBI IDCHEBI:216974
ChEBI NameGraphostrin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12ClNO4
Net Charge0
Average Mass269.684
Monoisotopic Mass269.04549
SMILESC[C@@H](O)[C@H](O)c1ncc(-c2ccc(O)c(Cl)c2)o1
InChIInChI=1S/C12H12ClNO4/c1-6(15)11(17)12-14-5-10(18-12)7-2-3-9(16)8(13)4-7/h2-6,11,15-17H,1H3/t6-,11+/m1/s1
InChIKeyGCJTYSWTARIPIP-KBUNVGBDSA-N
Species of MetaboliteComponentSourceComments
Graphostroma (ncbitaxon:190933) - PubMed (29355320)
ChEBI Ontology
Outgoing Relation(s)
Graphostrin A (CHEBI:216974) is a 1,3-oxazoles (CHEBI:46812)
IUPAC Name 
(1S,2R)-1-[5-(3-chloro-4-hydroxyphenyl)-1,3-oxazol-2-yl]propane-1,2-diol
Manual XrefsDatabases
65323341ChemSpider