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CHEBI:2520 - Agrostophyllin

ChEBI IDCHEBI:2520
ChEBI NameAgrostophyllin
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H14O4
Net Charge0
Average Mass282.295
Monoisotopic Mass282.08921
SMILESCOc1cc2c3c(ccc4cc(O)c(OC)c(c43)CO2)c1
InChIInChI=1S/C17H14O4/c1-19-11-5-9-3-4-10-6-13(18)17(20-2)12-8-21-14(7-11)16(9)15(10)12/h3-7,18H,8H2,1-2H3
InChIKeyJUXGBQIIXCBKIW-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)
Agrostophyllin (CHEBI:2520) is a phenanthrol (CHEBI:25962)
Synonym  Source
AgrostophyllinKEGG COMPOUND
Manual XrefsDatabases
C10244KEGG COMPOUND
C00002869KNApSAcK
Registry NumbersSources
CAS:116174-99-3KEGG COMPOUND