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

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ChEBI Name (1S,2R)-1,2-epoxy-1,2-dihydrophenanthrene
ChEBI ID CHEBI:37094
ChEBI ASCII Name (1S,2R)-1,2-epoxy-1,2-dihydrophenanthrene
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C14H10O
Net Charge 0
Average Mass 194.22860
Monoisotopic Mass 194.07316
InChI InChI=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
InChIKey ALTXUIJFJAHUPS-KGLIPLIRSA-N
SMILES O1[C@@H]2C=Cc3c(ccc4ccccc34)[C@H]12
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 (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 (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 Xref Database
C11431 KEGG COMPOUND
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Registry Numbers Types Sources
1426469 Beilstein Registry Number Beilstein
66226-25-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014