loading...| Preferred Name |
minocycline hydrochloride |
|
| Synonyms |
(4S,4aS,5aR,12aS)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride Arestin Dynacin Minocin Minomycin Solodyn |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_50697 |
|
| charge |
0 |
|
| database_cross_reference |
DrugBank:DB01017 CAS:13614-98-7 KEGG:D00850 PMID:24134630 Beilstein:4836328 KEGG:C08030 |
|
| formula |
C23H27N3O7.HCl C23H27N3O7.Cl.H C23H27N3O7.ClH C23H28ClN3O7 |
|
| has part | ||
| has_alternative_id |
CHEBI:6940 |
|
| has_exact_synonym |
(4S,4aS,5aR,12aS)-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
Arestin Dynacin Minocin Minomycin Solodyn |
|
| id |
CHEBI:50697 |
|
| in_subset | ||
| inchi |
InChI=1S/C23H27N3O7.ClH/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28;/h5-6,9,11,17,27,29-30,33H,7-8H2,1-4H3,(H2,24,32);1H/t9-,11-,17-,23-;/m0./s1 |
|
| inchikey |
GLMUAFMGXXHGLU-VQAITOIOSA-N |
|
| label |
minocycline hydrochloride |
|
| mass |
493.93714 |
|
| monoisotopicmass |
493.16158 |
|
| notation |
CHEBI:50697 |
|
| prefLabel |
minocycline hydrochloride |
|
| RO_0000087 | ||
| smiles |
[H+].[Cl-].[H][C@@]12Cc3c(ccc(O)c3C(=O)C1=C(O)[C@]1(O)C(=O)C(C(N)=O)=C(O)[C@@H](N(C)C)[C@]1([H])C2)N(C)C |
|
| subClassOf |