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CHEBI:206722 - Xanalteric acid I

ChEBI IDCHEBI:206722
ChEBI NameXanalteric acid I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC20H12O7
Net Charge0
Average Mass364.309
Monoisotopic Mass364.05830
SMILESO=C1C=Cc2c3c4c(c(O)ccc4c4ccc(O)c1c24)OC(C(=O)O)C3O
InChIInChI=1S/C20H12O7/c21-10-4-1-7-8-2-6-12(23)18-15(8)14(17(24)19(27-18)20(25)26)9-3-5-11(22)16(10)13(7)9/h1-6,17,19,21,23-24H,(H,25,26)
InChIKeySRAOLIZIJYDHTE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Alternariaspecies (ncbitaxon:1715220) - PubMed (19835393)
Roles Classification
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
ChEBI Ontology
Outgoing Relation(s)
Xanalteric acid I (CHEBI:206722) is a phenanthrol (CHEBI:25962)
IUPAC Name 
3,7,14-trihydroxy-16-oxo-5-oxapentacyclo[9.7.1.12,6.015,19.010,20]icosa-1(19),2(20),6,8,10,12,14,17-octaene-4-carboxylic acid
Manual XrefsDatabases
24662944ChemSpider