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> Main
CHEBI:6834 - methohexital sodium
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ChEBI Name
methohexital sodium
ChEBI ID
CHEBI:6834
Definition
The sodium salt of methohexital.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C14H17N2NaO3
Net Charge
0
Average Mass
284.28610
Monoisotopic Mass
284.11369
InChI
InChI=1S/C14H18N2O3.Na/c1-
5-
7-
8-
10(3)
14(9-
6-
2)
11(17)
15-
13(19)
16(4)
12(14)
18;/h6,10H,2,5,9H2,1,3-
4H3,(H,15,17,19)
;/q;+1/p-
1
InChIKey
KDXZREBVGAGZHS-UHFFFAOYSA-M
SMILES
[Na+].CCC#CC(C)C1(CC=C)C(=O)N=C([O-])N(C)C1=O
Roles Classification
Application
(s):
intravenous anaesthetic
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
methohexital sodium (
CHEBI:6834
)
has part
methohexital(1−) (
CHEBI:60792
)
methohexital sodium (
CHEBI:6834
)
has role
intravenous anaesthetic (
CHEBI:38877
)
methohexital sodium (
CHEBI:6834
)
is a
organic sodium salt (
CHEBI:38700
)
IUPAC Name
sodium 5-(hex-3-yn-2-yl)-1-methyl-4,6-dioxo-5-(prop-2-en-1-yl)-1,4,5,6-tetrahydropyrimidin-2-olate
Synonyms
Sources
methohexitone sodium
ChemIDplus
sodium 5-allyl-1-methyl-5-(1-methyl-2- pentynyl)barbiturate
ChemIDplus
sodium methohexital
ChemIDplus
Brand Names
Sources
Brevital
ChemIDplus
Brevital sodium
ChemIDplus
Brietal Sodium
ChEBI
Manual Xrefs
Databases
D00712
KEGG DRUG
DB00474
DrugBank
US2872448
Patent
View more database links
Registry Numbers
Types
Sources
309-36-4
CAS Registry Number
KEGG DRUG
309-36-4
CAS Registry Number
ChemIDplus
4284264
Reaxys Registry Number
Reaxys
Last Modified
09 December 2010
General Comment
2010-12-09
Methohexital is a short-acting barbiturate-type general anaesthetic. Usually administered as the sodium salt, it is 2-3 times more potent than thiopental but has a shorter duration of action.