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CHEBI:198591 - Pochonin H

ChEBI IDCHEBI:198591
ChEBI NamePochonin H
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H17ClO5
Net Charge0
Average Mass348.782
Monoisotopic Mass348.07645
SMILESC[C@@H]1C/C=C/Cc2ccc(o2)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
InChIInChI=1S/C18H17ClO5/c1-10-4-2-3-5-11-6-7-12(24-11)8-13-16(18(22)23-10)14(20)9-15(21)17(13)19/h2-3,6-7,9-10,20-21H,4-5,8H2,1H3/b3-2+/t10-/m1/s1
InChIKeyFMTPUVKFUGIZNF-VMZHVLLKSA-N
Species of MetaboliteComponentSourceComments
Pochonia (ncbitaxon:243023) - DOI (10.1016/j.tetlet.2008.10.099)
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 H (CHEBI:198591) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(11R,13E)-4-chloro-5,7-dihydroxy-11-methyl-10,19-dioxatricyclo[14.2.1.03,8]nonadeca-1(18),3(8),4,6,13,16-hexaen-9-one
Manual XrefsDatabases
78436379ChemSpider