CHEBI:33998 - (1R,2S)-naphthalene 1,2-oxide

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ChEBI Name (1R,2S)-naphthalene 1,2-oxide
ChEBI ID CHEBI:33998
ChEBI ASCII Name (1R,2S)-naphthalene 1,2-oxide
Definition A naphthalene 1,2-oxide (the 1R,2S-stereoisomer).
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C10H8O
Net Charge 0
Average Mass 144.16990
Monoisotopic Mass 144.05751
InChI InChI=1S/C10H8O/c1-2-4-8-7(3-1)5-6-9-10(8)11-9/h1-6,9-10H/t9-,10+/m0/s1
InChIKey XQIJIALOJPIKGX-VHSXEESVSA-N
SMILES O1[C@H]2C=Cc3ccccc3[C@@H]12
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
Roles Classification
Biological Role(s): mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing (1R,2S)-naphthalene 1,2-oxide (CHEBI:33998) has role mouse metabolite (CHEBI:75771)
(1R,2S)-naphthalene 1,2-oxide (CHEBI:33998) is a naphthalene 1,2-oxide (CHEBI:52431)
(1R,2S)-naphthalene 1,2-oxide (CHEBI:33998) is enantiomer of (1S,2R)-naphthalene 1,2-oxide (CHEBI:34001)
Incoming (1S,2R)-naphthalene 1,2-oxide (CHEBI:34001) is enantiomer of (1R,2S)-naphthalene 1,2-oxide (CHEBI:33998)
IUPAC Name
(1aS,7bR)-1a,7b-dihydronaphtho[1,2-b]oxirene
Synonyms Sources
(+)-(1R,2S)-Naphthalene epoxide ChEBI
(+)-1R,2S-Naphthalene epoxide ChEBI
(1R,2S)-1,2-epoxy-1,2-dihydronaphthalene ChEBI
(1R,2S)-Naphthalene 1,2-oxide KEGG COMPOUND
(1R,2S)-Naphthalene epoxide KEGG COMPOUND
Manual Xref Database
C14786 KEGG COMPOUND
View more database links
Registry Numbers Types Sources
4662168 Beilstein Registry Number Beilstein
73136-20-6 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
1742282 PubMed citation Europe PMC
1981702 PubMed citation Europe PMC
2888622 PubMed citation Europe PMC
Last Modified
14 September 2020