loading...| Preferred Name |
dibromothymoquinone |
|
| Synonyms |
2,5-dibromo-3-methyl-6-(1-methylethyl)cyclohexa-2,5-diene-1,4-dione 2,5-dibromo-3-isopropyl-6-methyl-1,4-benzoquinone 2,5-dibromo-3-methyl-6-(1-methylethyl)-2,5-cyclohexadiene-1,4-dione 2,5-dibromo-3-isopropyl-6-methylbenzoquinone DBMIB 2,5-dibromo-3-methyl-6-(propan-2-yl)cyclohexa-2,5-diene-1,4-dione |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_19371 |
|
| alternative term |
2,5-dibromo-3-methyl-6-(1-methylethyl)cyclohexa-2,5-diene-1,4-dione 2,5-dibromo-3-isopropyl-6-methyl-1,4-benzoquinone 2,5-dibromo-3-methyl-6-(1-methylethyl)-2,5-cyclohexadiene-1,4-dione 2,5-dibromo-3-isopropyl-6-methylbenzoquinone DBMIB 2,5-dibromo-3-methyl-6-(propan-2-yl)cyclohexa-2,5-diene-1,4-dione |
|
| bearer of | ||
| charge |
0 |
|
| database_cross_reference |
Beilstein:2265154 DrugBank:DB04646 CAS:29096-93-3 |
|
| formula |
C10H10Br2O2 |
|
| has_exact_synonym |
2,5-dibromo-3-methyl-6-(propan-2-yl)cyclohexa-2,5-diene-1,4-dione |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
2,5-dibromo-3-methyl-6-(1-methylethyl)cyclohexa-2,5-diene-1,4-dione 2,5-dibromo-3-isopropyl-6-methyl-1,4-benzoquinone 2,5-dibromo-3-methyl-6-(1-methylethyl)-2,5-cyclohexadiene-1,4-dione 2,5-dibromo-3-isopropyl-6-methylbenzoquinone DBMIB |
|
| id |
CHEBI:19371 |
|
| in_subset | ||
| inchi |
InChI=1S/C10H10Br2O2/c1-4(2)6-8(12)9(13)5(3)7(11)10(6)14/h4H,1-3H3 |
|
| inchikey |
GHHZELQYJPWSMG-UHFFFAOYSA-N |
|
| label |
dibromothymoquinone |
|
| mass |
321.99320 |
|
| monoisotopicmass |
319.90476 |
|
| notation |
CHEBI:19371 |
|
| prefLabel |
dibromothymoquinone |
|
| RO_0000087 | ||
| smiles |
CC(C)C1=C(Br)C(=O)C(C)=C(Br)C1=O |
|
| subClassOf |