CHEBI:6958 - Mivacurium

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name Mivacurium
ChEBI ID CHEBI:6958
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C58H80N2O14
Net Charge +2
Average Mass 1029.263
Monoisotopic Mass 1028.55986
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
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
ChEBI Ontology
Outgoing Mivacurium (CHEBI:6958) is a isoquinolines (CHEBI:24922)
Synonyms Sources
Mivacurium KEGG COMPOUND
mivacurium chloride DrugCentral
Manual Xrefs Databases
1822 DrugCentral
C07550 KEGG COMPOUND
HMDB0015357 HMDB
View more database links
Registry Numbers Types Sources
106791-40-6 CAS Registry Number KEGG COMPOUND
133814-19-4 CAS Registry Number DrugCentral
Last Modified
22 February 2017