CHEBI:201758 - Epitetracycline hydrochloride

ChEBI IDCHEBI:201758
ChEBI NameEpitetracycline hydrochloride
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SubmitterMetaboLights
DownloadsMolfile
FormulaC22H24N2O8.HCl
Net Charge0
Average Mass480.901
Monoisotopic Mass480.12994
SMILESCN(C)C1C(=O)C(C(N)=O)=C(O)C2(O)C(=O)C3=C(O)c4c(O)cccc4C(C)(O)C3CC12.Cl
InChIInChI=1S/C22H24N2O8.ClH/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28;/h4-6,9-10,15,25-26,29,31-32H,7H2,1-3H3,(H2,23,30);1H
InChIKeyYCIHPQHVWDULOY-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
Epitetracycline hydrochloride (CHEBI:201758) is a tetracyclines (CHEBI:26895)
IUPAC Name 
(4R,4aS,5aS,6S,12aR)-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide;hydrochloride
Manual XrefsDatabases
67027629ChemSpider
D04030KEGG DRUG