loading...| Preferred Name |
Metocurine |
|
| Synonyms |
Metocurine metocurine trimethyltubocurarine iodide metocurine iodide dimethyltubocurarine dimethyltubocurarinium chloride |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_6900 |
|
| charge |
+2 |
|
| database_cross_reference |
HMDB:HMDB0015429 CAS:5152-30-7 KEGG:C07919 Drug_Central:908 |
|
| formula |
C40H48N2O6 |
|
| has_exact_synonym |
Metocurine metocurine |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
trimethyltubocurarine iodide metocurine iodide dimethyltubocurarine dimethyltubocurarinium chloride |
|
| has_RxCUI |
29950 |
|
| id |
CHEBI:6900 |
|
| in_subset | ||
| inchi |
InChI=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 |
|
| inchikey |
JFXBEKISTKFVAB-AJQTZOPKSA-N |
|
| label |
Metocurine metocurine |
|
| mass |
652.820 |
|
| monoisotopicmass |
652.35014 |
|
| notation |
CHEBI:6900 |
|
| prefixIRI |
CHEBI:6900 |
|
| prefLabel |
Metocurine |
|
| smiles |
COc1ccc2C[C@@H]3c4c(CC[N+]3(C)C)cc(OC)c(OC)c4Oc3ccc(C[C@H]4c5cc(Oc1c2)c(OC)cc5CC[N+]4(C)C)cc3 |
|
| subClassOf |