loading...| Preferred Name |
vecuronium bromide |
|
| Synonyms |
(2beta,3alpha,5alpha,16beta,17beta)-3,17-diacetoxy-16-(1-methylpiperidinium-1-yl)-2-(piperidin-1-yl)androstane bromide vecuronium bromide bromure de vecuronium 1-(3alpha,17beta-Dihydroxy-2beta-piperidino-5alpha-androstan-16beta,5alpha-yl)-1-methylpiperidinium bromide, diacetate 1-[3alpha,17beta-bis(acetoxy)-2beta-(1-piperidinyl)-5alpha-androstan-16beta-yl]-1-methylpiperidinium bromide bromuro de vecuronio vecuronii bromidum |
|
| Definitions |
The organic bromide salt of a 5alpha-androstane compound having 3alpha-acetoxy-, 17beta-acetoxy-, 2beta-piperidinino- and 16beta-N-methylpiperidinium substituents. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_9940 |
|
| charge |
0 |
|
| database_cross_reference |
KEGG:D00767 Wikipedia:Vecuronium_bromide Reaxys:7164568 CAS:50700-72-6 Patent:CN101843593 PMID:21394728 Beilstein:7164568 PMID:17667569 DrugBank:DB01339 PMID:2889244 PMID:23615407 |
|
| definition |
The organic bromide salt of a 5alpha-androstane compound having 3alpha-acetoxy-, 17beta-acetoxy-, 2beta-piperidinino- and 16beta-N-methylpiperidinium substituents. |
|
| formula |
C34H57BrN2O4 C34H57N2O4.Br |
|
| has functional parent | ||
| has part | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_51372 |
|
| has_exact_synonym |
(2beta,3alpha,5alpha,16beta,17beta)-3,17-diacetoxy-16-(1-methylpiperidinium-1-yl)-2-(piperidin-1-yl)androstane bromide |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
vecuronium bromide bromure de vecuronium 1-(3alpha,17beta-Dihydroxy-2beta-piperidino-5alpha-androstan-16beta,5alpha-yl)-1-methylpiperidinium bromide, diacetate 1-[3alpha,17beta-bis(acetoxy)-2beta-(1-piperidinyl)-5alpha-androstan-16beta-yl]-1-methylpiperidinium bromide bromuro de vecuronio vecuronii bromidum |
|
| id |
CHEBI:9940 |
|
| in_subset | ||
| inchi |
InChI=1S/C34H57N2O4.BrH/c1-23(37)39-31-20-25-12-13-26-27(34(25,4)22-29(31)35-16-8-6-9-17-35)14-15-33(3)28(26)21-30(32(33)40-24(2)38)36(5)18-10-7-11-19-36;/h25-32H,6-22H2,1-5H3;1H/q+1;/p-1/t25-,26+,27-,28-,29-,30-,31-,32-,33-,34-;/m0./s1 |
|
| inchikey |
VEPSYABRBFXYIB-PWXDFCLTSA-M |
|
| label |
vecuronium bromide |
|
| mass |
637.73100 |
|
| monoisotopicmass |
636.35017 |
|
| notation |
CHEBI:9940 |
|
| prefLabel |
vecuronium bromide |
|
| smiles |
[Br-].[H][C@@]12CC[C@]3([H])[C@]([H])(CC[C@]4(C)[C@@H](OC(C)=O)[C@H](C[C@@]34[H])[N+]3(C)CCCCC3)[C@@]1(C)C[C@@H]([C@H](C2)OC(C)=O)N1CCCCC1 |
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| treeView | ||
| subClassOf |