loading...| Preferred Name |
phenobarbital sodium |
|
| Synonyms |
sodium 5-ethyl-4,6-dioxo-5-phenyl-1,4,5,6-tetrahydropyrimidin-2-olate phenobarbital sodique Sodium phenobarbiturate Luminal sodium phenobarbital sodium 5-Ethyl-5-phenylbarbituric acid sodium salt Phenyl-aethyl-barbitursaeure natrium phenobarbitalum natricum Sodium luminal Sodium 5-ethyl-5-phenylbarbiturate Sodium phenobarbital Sodium phenylethylmalonylurea Sodium phenylethylbarbiturate Phenobarbital sodium salt Sodium phenobarbitone |
|
| Definitions |
A barbiturate that is the sodium salt of phenobarbital (barbituric acid substituted at C-5 by ethyl and phenyl groups). |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_8070 |
|
| charge |
0 |
|
| database_cross_reference |
PMID:3705183 KEGG:D00701 PMID:3780232 PMID:7145596 CAS:57-30-7 PMID:6142138 PMID:11994495 PMID:12569987 Beilstein:3802044 PMID:17342914 PMID:3416937 |
|
| definition |
A barbiturate that is the sodium salt of phenobarbital (barbituric acid substituted at C-5 by ethyl and phenyl groups). |
|
| formula |
C12H11N2O3.Na C12H11N2NaO3 |
|
| has part | ||
| has_exact_synonym |
sodium 5-ethyl-4,6-dioxo-5-phenyl-1,4,5,6-tetrahydropyrimidin-2-olate |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
phenobarbital sodique Sodium phenobarbiturate Luminal sodium phenobarbital sodium 5-Ethyl-5-phenylbarbituric acid sodium salt Phenyl-aethyl-barbitursaeure natrium phenobarbitalum natricum Sodium luminal Sodium 5-ethyl-5-phenylbarbiturate Sodium phenobarbital Sodium phenylethylmalonylurea Sodium phenylethylbarbiturate Phenobarbital sodium salt Sodium phenobarbitone |
|
| id |
CHEBI:8070 |
|
| in_subset | ||
| inchi |
InChI=1S/C12H12N2O3.Na/c1-2-12(8-6-4-3-5-7-8)9(15)13-11(17)14-10(12)16;/h3-7H,2H2,1H3,(H2,13,14,15,16,17);/q;+1/p-1 |
|
| inchikey |
WRLGYAWRGXKSKG-UHFFFAOYSA-M |
|
| label |
phenobarbital sodium |
|
| mass |
254.21710 |
|
| monoisotopicmass |
254.06674 |
|
| notation |
CHEBI:8070 |
|
| prefLabel |
phenobarbital sodium |
|
| smiles |
[Na+].CCC1(C(=O)NC([O-])=NC1=O)c1ccccc1 |
|
| treeView | ||
| subClassOf |