CHEBI:39078 - bromoeosin

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name bromoeosin
ChEBI ID CHEBI:39078
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C20H8Br4O5
Net Charge 0
Average Mass 647.89052
Monoisotopic Mass 643.71052
InChI InChI=1S/C20H8Br4O5/c21-11-5-9-17(13(23)15(11)25)28-18-10(6-12(22)16(26)14(18)24)20(9)8-4-2-1-3-7(8)19(27)29-20/h1-6,25-26H
InChIKey DBZJJPROPLPMSN-UHFFFAOYSA-N
SMILES Oc1c(Br)cc2c(Oc3c(Br)c(O)c(Br)cc3C22OC(=O)c3ccccc23)c1Br
ChEBI Ontology
Outgoing bromoeosin (CHEBI:39078) has functional parent fluorescein (lactone form) (CHEBI:31624)
bromoeosin (CHEBI:39078) is a organobromine compound (CHEBI:37141)
IUPAC Name
2',4',5',7'-tetrabromo-3',6'-dihydroxy-3H-spiro[2-benzofuran-1,9'-xanthen]-3-one
Synonyms Sources
2',4',5',7'-Tetrabromofluorescein ChemIDplus
D & C Red no. 21 ChemIDplus
D & C Red no. 21 KEGG COMPOUND
Japan Red 223 ChemIDplus
Solvent Red 43 ChemIDplus
Spiro(isobenzofuran-1(3H),9'-(9H)xanthen)-3-one,2',4',5',7'-tetrabromo-3',6'-dihydroxy- ChemIDplus
Manual Xrefs Databases
4466 DrugCentral
C19416 KEGG COMPOUND
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Registry Numbers Types Sources
15086-94-9 CAS Registry Number KEGG COMPOUND
15086-94-9 CAS Registry Number ChemIDplus
63410 Beilstein Registry Number Beilstein
Last Modified
22 February 2017