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loading...| Preferred Name |
Chlorhexidine hydrochloride |
|
| Synonyms |
Chlorhexidine hydrochloride |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_31393 |
|
| charge |
0 |
|
| database_cross_reference |
KEGG:D01345 CAS:3697-42-5 |
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| formula |
C22H32Cl4N10 C22H30Cl2N10.2HCl |
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| has_exact_synonym |
Chlorhexidine hydrochloride |
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| has_obo_namespace |
chebi_ontology |
|
| id |
CHEBI:31393 |
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| in_subset | ||
| inchi |
InChI=1S/C22H30Cl2N10.2ClH/c23-15-5-9-17(10-6-15)31-21(27)33-19(25)29-13-3-1-2-4-14-30-20(26)34-22(28)32-18-11-7-16(24)8-12-18;;/h5-12H,1-4,13-14H2,(H5,25,27,29,31,33)(H5,26,28,30,32,34);2*1H |
|
| inchikey |
WJLVQTJZDCGNJN-UHFFFAOYSA-N |
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| label |
Chlorhexidine hydrochloride |
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| mass |
578.369 |
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| monoisotopicmass |
576.15655 |
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| notation |
CHEBI:31393 |
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| prefLabel |
Chlorhexidine hydrochloride |
|
| smiles |
C1(NC(NC(NCCCCCCNC(NC(NC2=CC=C(Cl)C=C2)=N)=N)=N)=N)=CC=C(Cl)C=C1.Cl.Cl |
|
| subClassOf |
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