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Biological and Environmental Research Ontology
Last uploaded:
December 23, 2022
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| Preferred Name | chlortetracycline | |
| Synonyms |
7-Chlorotetracycline chlortetracycline clortetraciclina chlortetracyclinum Aueromycin (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide |
|
| Definitions |
A member of the class of tetracyclines with formula C22H23ClN2O8 isolated from Streptomyces aureofaciens. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_27644 |
|
| alternative term |
7-Chlorotetracycline chlortetracycline clortetraciclina chlortetracyclinum Aueromycin (4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
|
|
| bearer of |
http://purl.obolibrary.org/obo/CHEBI_35820 http://purl.obolibrary.org/obo/CHEBI_22986 |
|
| charge |
0
|
|
| database_cross_reference |
PMID:25131164 PMID:7150561 PMID:23530364 PMID:25602656 KEGG:D07689 PMID:7988792 HMDB:HMDB0014401 KEGG:C06571 PDBeChem:CTC PMID:7390959 CAS:57-62-5 Drug_Central:624 PMID:24845506 LIPID_MAPS_instance:LMPK07000004 Patent:US2482055
|
|
| definition |
A member of the class of tetracyclines with formula C22H23ClN2O8 isolated from Streptomyces aureofaciens.
|
|
| formula |
C22H23ClN2O8
|
|
| has_alternative_id |
CHEBI:23164 CHEBI:3653
|
|
| has_exact_synonym |
(4S,4aS,5aS,6S,12aS)-7-chloro-4-(dimethylamino)-3,6,10,12,12a-pentahydroxy-6-methyl-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide
|
|
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
7-Chlorotetracycline chlortetracycline clortetraciclina chlortetracyclinum Aueromycin
|
|
| id |
CHEBI:27644
|
|
| in_subset | ||
| inchi |
InChI=1S/C22H23ClN2O8/c1-21(32)7-6-8-15(25(2)3)17(28)13(20(24)31)19(30)22(8,33)18(29)11(7)16(27)12-10(26)5-4-9(23)14(12)21/h4-5,7-8,15,26,28-29,32-33H,6H2,1-3H3,(H2,24,31)/t7-,8-,15-,21-,22-/m0/s1
|
|
| inchikey |
CYDMQBQPVICBEU-XRNKAMNCSA-N
|
|
| is_conjugate_acid_of | ||
| label |
chlortetracycline
|
|
| mass |
478.88000
|
|
| monoisotopicmass |
478.11429
|
|
| notation |
CHEBI:27644
|
|
| prefLabel |
chlortetracycline
|
|
| RO_0000087 |
http://purl.obolibrary.org/obo/CHEBI_35820 http://purl.obolibrary.org/obo/CHEBI_22986 |
|
| smiles |
CN(C)[C@H]1[C@@H]2C[C@H]3C(=C(O)[C@]2(O)C(=O)C(C(N)=O)=C1O)C(=O)c1c(O)ccc(Cl)c1[C@@]3(C)O
|
|
| subClassOf |
http://purl.obolibrary.org/obo/CHEBI_139592 http://purl.obolibrary.org/obo/CHEBI_83403 http://purl.obolibrary.org/obo/CHEBI_29347 |
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