loading...| Preferred Name | demeclocycline hydrochloride | |
| Synonyms |
demeclocycline HCl 7-chloro-6-demethyltetracycline hydrochloride [4S-(4alpha,4aalpha,5aalpha,6beta,12aalpha)]-7-chloro-4-(dimethylamino)1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-2-naphthacenecarboxamide hydrochloride demeclocycline hydrochloride 6-demethyl-7-chlorotetracycline hydrochloride (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride |
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| Definitions |
The hydrochloride salt of demeclocycline. A tetracycline antibiotic, it is used (mainly as the hydrochloride) for the treatment of Lyme disease, acne and bronchitis, as well as for hyponatraemia (low blood sodium concentration) due to the syndrome of inappropriate antidiuretic hormone (SIADH) where fluid restriction alone has been ineffective. |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_59725 |
|
| alternative term |
demeclocycline HCl 7-chloro-6-demethyltetracycline hydrochloride [4S-(4alpha,4aalpha,5aalpha,6beta,12aalpha)]-7-chloro-4-(dimethylamino)1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-2-naphthacenecarboxamide hydrochloride demeclocycline hydrochloride 6-demethyl-7-chlorotetracycline hydrochloride (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride |
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| bearer of | ||
| charge |
0 |
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| database_cross_reference |
CAS:64-73-3 DrugBank:DB00618 Beilstein:5705221 KEGG:D00290 |
|
| definition |
The hydrochloride salt of demeclocycline. A tetracycline antibiotic, it is used (mainly as the hydrochloride) for the treatment of Lyme disease, acne and bronchitis, as well as for hyponatraemia (low blood sodium concentration) due to the syndrome of inappropriate antidiuretic hormone (SIADH) where fluid restriction alone has been ineffective. |
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| formula |
C21H22Cl2N2O8 |
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| has part | ||
| has_exact_synonym |
(4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride |
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| has_obo_namespace |
chebi_ontology |
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| has_related_synonym |
demeclocycline HCl 7-chloro-6-demethyltetracycline hydrochloride [4S-(4alpha,4aalpha,5aalpha,6beta,12aalpha)]-7-chloro-4-(dimethylamino)1,4,4a,5,5a,6,11,12a-octahydro-3,6,10,12,12a-pentahydroxy-1,11-dioxo-2-naphthacenecarboxamide hydrochloride demeclocycline hydrochloride 6-demethyl-7-chlorotetracycline hydrochloride |
|
| id |
CHEBI:59725 |
|
| in_subset | ||
| inchi |
InChI=1S/C21H21ClN2O8.ClH/c1-24(2)14-7-5-6-10(16(27)12-9(25)4-3-8(22)11(12)15(6)26)18(29)21(7,32)19(30)13(17(14)28)20(23)31;/h3-4,6-7,14-15,25-26,28-29,32H,5H2,1-2H3,(H2,23,31);1H/t6-,7-,14-,15-,21-;/m0./s1 |
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| inchikey |
GVSJQNRGSCOSNJ-KBHRXELFSA-N |
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| label |
demeclocycline hydrochloride |
|
| mass |
501.31400 |
|
| monoisotopicmass |
500.07532 |
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| notation |
CHEBI:59725 |
|
| overlaps | ||
| prefLabel |
demeclocycline hydrochloride |
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| RO_0000087 | ||
| smiles |
Cl.[H][C@]12C[C@@]3([H])[C@H](N(C)C)C(O)=C(C(N)=O)C(=O)[C@@]3(O)C(O)=C1C(=O)c1c(O)ccc(Cl)c1[C@H]2O |
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| subClassOf |