Preferred Name |
mivacurium |
|
Synonyms |
Mivacurium mivacurium chloride |
|
ID |
http://purl.obolibrary.org/obo/CHEBI_6958 |
|
charge |
+2 |
|
database_cross_reference |
Drug_Central:1822 HMDB:HMDB0015357 CAS:106791-40-6 KEGG:C07550 CAS:133814-19-4 |
|
formula |
C58H80N2O14 |
|
has_exact_synonym |
Mivacurium |
|
has_obo_namespace |
chebi_ontology |
|
has_related_synonym |
mivacurium chloride |
|
has_RxCUI |
30077 |
|
id |
CHEBI:6958 |
|
in_subset | ||
inchi |
InChI=1S/C58H80N2O14/c1-59(25-21-41-35-47(63-3)49(65-5)37-43(41)45(59)29-39-31-51(67-7)57(71-11)52(32-39)68-8)23-17-27-73-55(61)19-15-13-14-16-20-56(62)74-28-18-24-60(2)26-22-42-36-48(64-4)50(66-6)38-44(42)46(60)30-40-33-53(69-9)58(72-12)54(34-40)70-10/h13-14,31-38,45-46H,15-30H2,1-12H3/q+2/b14-13+/t45-,46-,59?,60?/m1/s1 |
|
inchikey |
ILVYCEVXHALBSC-OTBYEXOQSA-N |
|
label |
Mivacurium mivacurium |
|
mass |
1029.263 |
|
monoisotopicmass |
1028.55986 |
|
notation |
CHEBI:6958 |
|
prefLabel |
mivacurium |
|
smiles |
COc1cc2CC[N+](C)(CCCOC(=O)CC\C=C\CCC(=O)OCCC[N+]3(C)CCc4cc(OC)c(OC)cc4[C@H]3Cc3cc(OC)c(OC)c(OC)c3)[C@H](Cc3cc(OC)c(OC)c(OC)c3)c2cc1OC |
|
subClassOf |