CHEBI:156496 - phloxine O

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ChEBI Name phloxine O ChEBI ID CHEBI:156496 Definition A xanthene dye that is fluorescein in which the hydrogens at positions 2',4',5' and 7' are replaced by bromo groups, and the hydrogens at positions 4,5,6 and 7 are replaced by chloro groups. It is a red synthetic pigment which is widely used in colored cosmetics (e.g. lipsticks and blushers). Stars This entity has been manually annotated by the ChEBI Team. Submitter Stan Laulederkind Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C20H4Br4Cl4O5 Net Charge 0 Average Mass 785.660 Monoisotopic Mass 779.55464 InChI InChI=1S/C20H4Br4Cl4O5/c21-5-1-3-17(9(23)15(5)29)32-18-4(2-6(22)16(30)10(18)24)20(3)8-7(19(31)33-20)11(25)13(27)14(28)12(8)26/h1-2,29-30H InChIKey ZYIBVBKZZZDFOY-UHFFFAOYSA-N SMILES OC1=C(Br)C2=C(C=C1Br)C1(OC(=O)C3=C1C(Cl)=C(Cl)C(Cl)=C3Cl)C1=CC(Br)=C(O)C(Br)=C1O2 Roles Classification Application(s): fluorescent dye dye (via xanthene dye ) View more via ChEBI Ontology ChEBI Ontology Outgoing phloxine O (CHEBI:156496) has functional parent fluorescein (lactone form) (CHEBI:31624) phloxine O (CHEBI:156496) has role fluorescent dye (CHEBI:51121) phloxine O (CHEBI:156496) is a γ-lactone (CHEBI:37581) phloxine O (CHEBI:156496) is a 2-benzofurans (CHEBI:38831) phloxine O (CHEBI:156496) is a dibromobenzene (CHEBI:37147) phloxine O (CHEBI:156496) is a organic heteropentacyclic compound (CHEBI:38164) phloxine O (CHEBI:156496) is a oxaspiro compound (CHEBI:37948) phloxine O (CHEBI:156496) is a polyphenol (CHEBI:26195) phloxine O (CHEBI:156496) is a tetrachlorobenzene (CHEBI:26888) phloxine O (CHEBI:156496) is a xanthene dye (CHEBI:37929) IUPAC Name 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxy-3H-spiro[[2]benzofuran-1,9'-xanthen]-3-one Synonyms Sources 2',4',5',7'-tetrabromo-4,5,6,7-tetrachloro-3',6'-dihydroxyspiro[isobenzofuran-1(3H),9'-[9H]xanthen]-3-one ChEBI 2',4',5',7'-tetrabromo-4,5,6,7-tetrachlorofluorescein ChEBI acid phloxine PB ChemIDplus C.I. 45410A ChemIDplus C.I. solvent red 48 ChemIDplus CI 45410:1 ChemIDplus CI Solvent Red 48 ChEBI D & C red No. 27 ChemIDplus D and C red No. 27 ChemIDplus Japan red 218 ChemIDplus phloxine BBN supra ChemIDplus red No. 218 ChemIDplus solvent red 48 ChemIDplus Registry Number Type Source 13473-26-2 CAS Registry Number ChemIDplus Citations Types Sources 12924789 PubMed citation Europe PMC 16494889 PubMed citation Europe PMC 22475185 PubMed citation Europe PMC 24646430 PubMed citation Europe PMC 29310423 PubMed citation SUBMITTER Last Modified 22 September 2020