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CHEBI:63836 - bromosulfophthalein
| Formula | C20H10Br4O10S2 |
| Net Charge | 0 |
| Average Mass | 794.040 |
| Monoisotopic Mass | 789.64489 |
| SMILES | O=C1OC(c2ccc(O)c(S(=O)(=O)O)c2)(c2ccc(O)c(S(=O)(=O)O)c2)c2c(Br)c(Br)c(Br)c(Br)c21 |
| InChI | InChI=1S/C20H10Br4O10S2/c21-15-13-14(16(22)18(24)17(15)23)20(34-19(13)27,7-1-3-9(25)11(5-7)35(28,29)30)8-2-4-10(26)12(6-8)36(31,32)33/h1-6,25-26H,(H,28,29,30)(H,31,32,33) |
| InChIKey | OHTXTCNTQJFRIG-UHFFFAOYSA-N |
| Roles Classification |
|---|
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| bromosulfophthalein (CHEBI:63836) has functional parent 2-benzofuran-1(3H)-one (CHEBI:38085) |
| bromosulfophthalein (CHEBI:63836) has role dye (CHEBI:37958) |
| bromosulfophthalein (CHEBI:63836) is a 2-benzofurans (CHEBI:38831) |
| bromosulfophthalein (CHEBI:63836) is a organobromine compound (CHEBI:37141) |
| bromosulfophthalein (CHEBI:63836) is a organosulfonic acid (CHEBI:33551) |
| bromosulfophthalein (CHEBI:63836) is a phenols (CHEBI:33853) |
| bromosulfophthalein (CHEBI:63836) is conjugate acid of bromosulfophthalein(2−) (CHEBI:63832) |
| Incoming Relation(s) |
| bromosulfophthalein(2−) (CHEBI:63832) is conjugate base of bromosulfophthalein (CHEBI:63836) |
| IUPAC Name |
|---|
| 3,3'-(4,5,6,7-tetrabromo-3-oxo-1,3-dihydro-2-benzofuran-1,1-diyl)bis(6-hydroxybenzenesulfonic acid) |
| Synonyms | Source |
|---|---|
| Sulphobromophthalein | ChemIDplus |
| 4,5,6,7-tetrabromo-3',3''-disulfophenolphthalein | ChemIDplus |