loading...| Preferred Name | aprobarbital | |
| Synonyms |
5-allyl-5-isopropylbarbituric acid 5-isopropyl-5-allylbarbituric acid 5-allyl-5-isopropylpyrimidine-2,4,6(1H,3H,5H)-trione Alurate 5-(1-methylethyl)-5-(2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione Allypropymal Aprobarbital 5-(propan-2-yl)-5-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione |
|
| Definitions |
A member of the class of barbiturates that is pyrimidine-2,4,6(1H,3H,5H)-trione substituted by an isopropyl and a prop-1-en-3-yl group at position 5. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_2791 |
|
| charge |
0 |
|
| database_cross_reference |
Reaxys:180858 PMID:5034548 KEGG:D00698 Gmelin:281329 DrugBank:DB01352 PMID:8313534 Wikipedia:Aprobarbital KEGG:C07826 CAS:77-02-1 Drug_Central:232 HMDB:HMDB0015441 |
|
| definition |
A member of the class of barbiturates that is pyrimidine-2,4,6(1H,3H,5H)-trione substituted by an isopropyl and a prop-1-en-3-yl group at position 5. |
|
| formula |
C10H14N2O3 |
|
| has_exact_synonym |
Aprobarbital 5-(propan-2-yl)-5-(prop-2-en-1-yl)pyrimidine-2,4,6(1H,3H,5H)-trione |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
5-allyl-5-isopropylbarbituric acid 5-isopropyl-5-allylbarbituric acid 5-allyl-5-isopropylpyrimidine-2,4,6(1H,3H,5H)-trione Alurate 5-(1-methylethyl)-5-(2-propenyl)-2,4,6(1H,3H,5H)-pyrimidinetrione Allypropymal |
|
| id |
CHEBI:2791 |
|
| in_subset | ||
| inchi |
InChI=1S/C10H14N2O3/c1-4-5-10(6(2)3)7(13)11-9(15)12-8(10)14/h4,6H,1,5H2,2-3H3,(H2,11,12,13,14,15) |
|
| inchikey |
UORJNBVJVRLXMQ-UHFFFAOYSA-N |
|
| label |
aprobarbital |
|
| mass |
210.22984 |
|
| monoisotopicmass |
210.10044 |
|
| notation |
CHEBI:2791 |
|
| prefLabel |
aprobarbital |
|
| smiles |
CC(C)C1(CC=C)C(=O)NC(=O)NC1=O |
|
| treeView | ||
| subClassOf |