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CHEBI:6806 - Methacycline hydrochloride

Default Structure
ChEBI IDCHEBI:6806
ChEBI NameMethacycline hydrochloride
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC22H22N2O8.HCl
Net Charge0
Average Mass478.885
Monoisotopic Mass478.11429
SMILESCl.[H][C@@]12C(=C)c3cccc(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])[C@H]2O
InChIInChI=1S/C22H22N2O8.ClH/c1-7-8-5-4-6-9(25)11(8)16(26)12-10(7)17(27)14-15(24(2)3)18(28)13(21(23)31)20(30)22(14,32)19(12)29;/h4-6,10,14-15,17,25,27-29,32H,1H2,2-3H3,(H2,23,31);1H/t10-,14-,15+,17+,22+;/m1./s1
InChIKeyVZQARNDJLLWXGL-CCHMMTNSSA-N
ChEBI Ontology
Outgoing Relation(s)
Methacycline hydrochloride (CHEBI:6806) is a organic molecular entity (CHEBI:50860)
Synonym  Source
Methacycline hydrochlorideKEGG COMPOUND
Manual XrefsDatabases
C08029KEGG COMPOUND
D00849KEGG DRUG
Registry NumbersSources
CAS:3963-95-9KEGG COMPOUND