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loading...| Preferred Name |
(S)-isoconazole(1+) |
| Synonyms |
(S)-isoconazole cation |
| Definitions |
An organic cation obtained by protonation of the imidazole group of (S)-isoconazole. |
| ID |
http://purl.obolibrary.org/obo/CHEBI_83673 |
| charge |
+1 |
| definition |
An organic cation obtained by protonation of the imidazole group of (S)-isoconazole. |
| formula |
C18H15Cl4N2O |
| has_obo_namespace |
chebi_ontology |
| has_related_synonym |
(S)-isoconazole cation |
| id |
CHEBI:83673 |
| in_subset | |
| inchi |
InChI=1S/C18H14Cl4N2O/c19-12-4-5-13(17(22)8-12)18(9-24-7-6-23-11-24)25-10-14-15(20)2-1-3-16(14)21/h1-8,11,18H,9-10H2/p+1/t18-/m1/s1 |
| inchikey |
MPIPASJGOJYODL-GOSISDBHSA-O |
| is conjugate acid of | |
| is enantiomer of | |
| label |
(S)-isoconazole(1+) |
| mass |
417.13600 |
| monoisotopicmass |
414.99330 |
| notation |
CHEBI:83673 |
| prefLabel |
(S)-isoconazole(1+) |
| smiles |
[H+].Clc1ccc([C@@H](Cn2ccnc2)OCc2c(Cl)cccc2Cl)c(Cl)c1 |
| treeView | |
| subClassOf |
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| Delete | Mapping To | Ontology | Source |
|---|---|---|---|
| http://purl.obolibrary.org/obo/CHEBI_83673 | The Drug Ontology / 药物本体 | LOOM | |
| http://purl.obolibrary.org/obo/CHEBI_83673 | The Drug Ontology / 药物本体 | SAME_URI |