CHEBI:81618 - Pyrene-1,2-oxide

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ChEBI Name Pyrene-1,2-oxide
ChEBI ID CHEBI:81618
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H10O
Net Charge 0
Average Mass 218.25000
Monoisotopic Mass 218.07316
InChI InChI=1S/C16H10O/c1-2-9-4-5-11-8-13-16(17-13)12-7-6-10(3-1)14(9)15(11)12/h1-8,13,16H
InChIKey IRYBKFGKUNZRSI-UHFFFAOYSA-N
SMILES O1C2C=c3ccc4cccc5ccc(C12)c3c45
Roles Classification
Biological Role(s): 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.
(via phenanthrenes )
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ChEBI Ontology
Outgoing Pyrene-1,2-oxide (CHEBI:81618) is a phenanthrenes (CHEBI:25961)
Manual Xref Database
C18267 KEGG COMPOUND
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