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CHEBI:208783 - Pochonin J

ChEBI IDCHEBI:208783
ChEBI NamePochonin J
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H22O7
Net Charge0
Average Mass350.367
Monoisotopic Mass350.13655
SMILESC[C@@H]1C[C@@H]2O[C@H](CC[C@H]2O)CC(=O)Cc2cc(O)cc(O)c2C(=O)O1
InChIInChI=1S/C18H22O7/c1-9-4-16-14(21)3-2-13(25-16)7-11(19)5-10-6-12(20)8-15(22)17(10)18(23)24-9/h6,8-9,13-14,16,20-22H,2-5,7H2,1H3/t9-,13-,14-,16+/m1/s1
InChIKeyIZYRYRLSUIPQLP-OLUKKTBOSA-N
Species of MetaboliteComponentSourceComments
Pochonia (ncbitaxon:243023) - DOI (10.1016/j.tetlet.2008.10.099)
ChEBI Ontology
Outgoing Relation(s)
Pochonin J (CHEBI:208783) is a macrolide (CHEBI:25106)
IUPAC Name 
(1R,13R,15S,16R)-7,9,16-trihydroxy-13-methyl-12,19-dioxatricyclo[13.3.1.05,10]nonadeca-5(10),6,8-triene-3,11-dione
Manual XrefsDatabases
28288826ChemSpider