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CHEBI:206705 - Pochonin O

ChEBI IDCHEBI:206705
ChEBI NamePochonin O
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H21ClO7
Net Charge0
Average Mass384.812
Monoisotopic Mass384.09758
SMILESC[C@@H]1C[C@@H]2O[C@@H]2CC(O)CCC(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
InChIInChI=1S/C18H21ClO7/c1-8-4-14-15(26-14)6-10(21)3-2-9(20)5-11-16(18(24)25-8)12(22)7-13(23)17(11)19/h7-8,10,14-15,21-23H,2-6H2,1H3/t8-,10?,14+,15-/m1/s1
InChIKeyFWJXUORZSYISJM-PCDCQAMYSA-N
Species of MetaboliteComponentSourceComments
Pochonia (ncbitaxon:243023) - DOI (10.1016/j.tet.2009.02.027)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Pochonin O (CHEBI:206705) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(4R,6S,8R)-16-chloro-10,17,19-trihydroxy-4-methyl-3,7-dioxatricyclo[13.4.0.06,8]nonadeca-1(15),16,18-triene-2,13-dione
Manual XrefsDatabases
78438410ChemSpider