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CHEBI:3806 - Coelogin

ChEBI IDCHEBI:3806
ChEBI NameCoelogin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H16O5
Net Charge0
Average Mass300.310
Monoisotopic Mass300.09977
SMILESCOc1c(O)c2c3c(c1OC)CCc1cc(O)cc(c1-3)OC2
InChIInChI=1S/C17H16O5/c1-20-16-10-4-3-8-5-9(18)6-12-13(8)14(10)11(7-22-12)15(19)17(16)21-2/h5-6,18-19H,3-4,7H2,1-2H3
InChIKeyQLYYIQVXUQYKGV-UHFFFAOYSA-N
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)
Coelogin (CHEBI:3806) is a phenanthrenes (CHEBI:25961)
Synonym  Source
CoeloginKEGG COMPOUND
Manual XrefsDatabases
C10251KEGG COMPOUND
C00002875KNApSAcK
Registry NumbersSources
CAS:82358-31-4KEGG COMPOUND