CHEBI:59678 - 6-carboxy-2',7'-dichlorofluorescein

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-carboxy-2',7'-dichlorofluorescein
ChEBI ID CHEBI:59678
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C21H10Cl2O7
Net Charge 0
Average Mass 445.20600
Monoisotopic Mass 443.98036
InChI InChI=1S/C21H10Cl2O7/c22-13-4-11-17(6-15(13)24)29-18-7-16(25)14(23)5-12(18)21(11)10-3-8(19(26)27)1-2-9(10)20(28)30-21/h1-7,24-25H,(H,26,27)
InChIKey HLRKQIBTEHWNND-UHFFFAOYSA-N
SMILES OC(=O)c1ccc2C(=O)OC3(c4cc(Cl)c(O)cc4Oc4cc(O)c(Cl)cc34)c2c1
ChEBI Ontology
Outgoing 6-carboxy-2',7'-dichlorofluorescein (CHEBI:59678) is a oxaspiro compound (CHEBI:37948)
Incoming 5(6)-carboxy-2',7'-dichlorofluorescein (CHEBI:51619) has part 6-carboxy-2',7'-dichlorofluorescein (CHEBI:59678)
IUPAC Name
2',7'-dichloro-3',6'-dihydroxy-3-oxo-3H-spiro[2-benzofuran-1,9'-xanthene]-6-carboxylic acid
Last Modified
28 June 2010