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CHEBI:83588 - (S)-eberconazole

ChEBI IDCHEBI:83588
ChEBI Name(S)-eberconazole
Stars
ASCII Name(S)-eberconazole
Definition1-(2,4-dichloro-10,11-dihydrodibenzo[a,d][7]annulen-5-yl)imidazole that is the (S)-enantiomer of eberconazole.
Last Modified6 November 2014
SubmitterSteve
DownloadsMolfile
FormulaC18H14Cl2N2
Net Charge0
Average Mass329.230
Monoisotopic Mass328.05340
SMILESClc1cc(Cl)c2c(c1)CCc1ccccc1[C@@H]2n1ccnc1
InChIInChI=1S/C18H14Cl2N2/c19-14-9-13-6-5-12-3-1-2-4-15(12)18(17(13)16(20)10-14)22-8-7-21-11-22/h1-4,7-11,18H,5-6H2/t18-/m0/s1
InChIKeyMPTJIDOGFUQSQH-SFHVURJKSA-N
Roles Classification
Biological Role:
carcinogenic agent  A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
Application:
endocrine disruptor  Any compound that can disrupt the functions of the endocrine (hormone) system
ChEBI Ontology
Outgoing Relation(s)
(S)-eberconazole (CHEBI:83588) is a 1-(2,4-dichloro-10,11-dihydrodibenzo[a,d][7]annulen-5-yl)imidazole (CHEBI:83584)
(S)-eberconazole (CHEBI:83588) is conjugate base of (S)-eberconazole(1+) (CHEBI:83596)
(S)-eberconazole (CHEBI:83588) is enantiomer of (R)-eberconazole (CHEBI:83587)
Incoming Relation(s)
eberconazole (CHEBI:82862) has part (S)-eberconazole (CHEBI:83588)
(S)-eberconazole(1+) (CHEBI:83596) is conjugate acid of (S)-eberconazole (CHEBI:83588)
(R)-eberconazole (CHEBI:83587) is enantiomer of (S)-eberconazole (CHEBI:83588)
IUPAC Name 
1-[(5S)-2,4-dichloro-10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-yl]-1H-imidazole