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CHEBI:31816 - Meluadrine tartrate

ChEBI IDCHEBI:31816
ChEBI NameMeluadrine tartrate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC12H18ClNO2.C4H6O6
Net Charge0
Average Mass393.820
Monoisotopic Mass393.11904
SMILESCC(C)(C)NC[C@H](O)c1ccc(O)cc1Cl.O=C(O)[C@H](O)[C@@H](O)C(=O)O
InChIInChI=1S/C12H18ClNO2.C4H6O6/c1-12(2,3)14-7-11(16)9-5-4-8(15)6-10(9)13;5-1(3(7)8)2(6)4(9)10/h4-6,11,14-16H,7H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/t11-;1-,2-/m01/s1
InChIKeyVVIVBRYHTLRZGY-MBANBULQSA-N
ChEBI Ontology
Outgoing Relation(s)
Meluadrine tartrate (CHEBI:31816) is a monochlorophenol (CHEBI:38857)
Synonyms  Source
Meluadrine tartrateKEGG COMPOUND
HSR 81KEGG COMPOUND
Manual XrefsDatabases
D01850KEGG DRUG
Registry NumbersSources
CAS:134865-37-5KEGG COMPOUND