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CHEBI:6900 - Metocurine

ChEBI IDCHEBI:6900
ChEBI NameMetocurine
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC40H48N2O6
Net Charge+2
Average Mass652.832
Monoisotopic Mass652.35014
SMILES[H][C@]12Cc3ccc(cc3)Oc3c(OC)c(OC)cc4c3[C@@]([H])(Cc3ccc(OC)c(c3)Oc3cc1c(cc3OC)CC[N+]2(C)C)[N+](C)(C)CC4
InChIInChI=1S/C40H48N2O6/c1-41(2)17-15-27-22-34(44-6)36-24-30(27)31(41)19-25-9-12-29(13-10-25)47-40-38-28(23-37(45-7)39(40)46-8)16-18-42(3,4)32(38)20-26-11-14-33(43-5)35(21-26)48-36/h9-14,21-24,31-32H,15-20H2,1-8H3/q+2/t31-,32+/m0/s1
InChIKeyJFXBEKISTKFVAB-AJQTZOPKSA-N
ChEBI Ontology
Outgoing Relation(s)
Metocurine (CHEBI:6900) is a isoquinolines (CHEBI:24922)
Synonyms  Source
MetocurineKEGG COMPOUND
metocurine iodideDrugCentral
dimethyltubocurarineDrugCentral
trimethyltubocurarine iodideDrugCentral
metocurineDrugCentral
dimethyltubocurarinium chlorideDrugCentral
Manual XrefsDatabases
C07919KEGG COMPOUND
908DrugCentral
HMDB0015429HMDB
Registry NumbersSources
CAS:5152-30-7KEGG COMPOUND