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CHEBI:37094 - (1S,2R)-1,2-epoxy-1,2-dihydrophenanthrene

ChEBI IDCHEBI:37094
ChEBI Name(1S,2R)-1,2-epoxy-1,2-dihydrophenanthrene
Stars
ASCII Name(1S,2R)-1,2-epoxy-1,2-dihydrophenanthrene
Last Modified28 July 2014
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC14H10O
Net Charge0
Average Mass194.233
Monoisotopic Mass194.07316
SMILESC1=C[C@H]2O[C@H]2c2ccc3ccccc3c21
InChIInChI=1S/C14H10O/c1-2-4-10-9(3-1)5-6-12-11(10)7-8-13-14(12)15-13/h1-8,13-14H/t13-,14+/m1/s1
InChIKeyALTXUIJFJAHUPS-KGLIPLIRSA-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)
(1S,2R)-1,2-epoxy-1,2-dihydrophenanthrene (CHEBI:37094) is a 1,2-epoxy-1,2-dihydrophenanthrene (CHEBI:28668)
(1S,2R)-1,2-epoxy-1,2-dihydrophenanthrene (CHEBI:37094) is enantiomer of (1R,2S)-1,2-epoxy-1,2-dihydrophenanthrene (CHEBI:37095)
Incoming Relation(s)
(1R,2S)-1,2-epoxy-1,2-dihydrophenanthrene (CHEBI:37095) is enantiomer of (1S,2R)-1,2-epoxy-1,2-dihydrophenanthrene (CHEBI:37094)
IUPAC Name 
(1aS,9aR)-1a,9a-dihydrophenanthro[1,2-b]oxirene
Manual XrefsDatabases
C11431KEGG COMPOUND
Registry NumbersSources
Beilstein:1426469Beilstein
CAS:66226-25-3KEGG COMPOUND