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CHEBI:218737 - Pochonin I

ChEBI IDCHEBI:218737
ChEBI NamePochonin I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC18H15ClO5
Net Charge0
Average Mass346.766
Monoisotopic Mass346.06080
SMILESC[C@@H]1Cc2ccccc2C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
InChIInChI=1S/C18H15ClO5/c1-9-6-10-4-2-3-5-11(10)13(20)7-12-16(18(23)24-9)14(21)8-15(22)17(12)19/h2-5,8-9,21-22H,6-7H2,1H3/t9-/m1/s1
InChIKeyXQFBITSYAUZTRB-SECBINFHSA-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 I (CHEBI:218737) is a hydroxybenzoic acid (CHEBI:24676)
IUPAC Name 
(7R)-1-chloro-2,4-dihydroxy-7-methyl-8,14-dihydro-7H-benzo[e][2]benzoxecine-5,13-dione
Manual XrefsDatabases
78437610ChemSpider