CHEBI:52737 - FluorX 5-isomer

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ChEBI Name FluorX 5-isomer
ChEBI ID CHEBI:52737
Definition The 5-isomer of FluorX.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H23NO8
Net Charge 0
Average Mass 489.47340
Monoisotopic Mass 489.14237
InChI InChI=1S/C27H23NO8/c29-16-6-9-19-22(13-16)36-23-14-17(30)7-10-20(23)25(19)18-8-5-15(12-21(18)27(34)35)26(33)28-11-3-1-2-4-24(31)32/h5-10,12-14,29H,1-4,11H2,(H,28,33)(H,31,32)(H,34,35)
InChIKey HAKKVJHTMKXGOT-UHFFFAOYSA-N
SMILES OC(=O)CCCCCNC(=O)c1ccc(c(c1)C(O)=O)-c1c2ccc(O)cc2oc2cc(=O)ccc12
Roles Classification
Application(s): fluorochrome
A fluorescent dye used to stain biological specimens.
(via FluorX )
dye

(via xanthene dye )
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ChEBI Ontology
Outgoing FluorX 5-isomer (CHEBI:52737) has functional parent fluorescin (CHEBI:42492)
FluorX 5-isomer (CHEBI:52737) has role fluorochrome (CHEBI:51217)
FluorX 5-isomer (CHEBI:52737) is a FluorX (CHEBI:52736)
IUPAC Name
5-[(5-carboxypentyl)carbamoyl]-2-(6-hydroxy-3-oxo-3H-xanthen-9-yl)benzoic acid
Last Modified
25 July 2011
General Comment
2009-07-13 The numbering of the 5-(5-carboxypentyl)carbamoyl substituent on the phenyl ring is based upon the numbering of the ring-closed lactone tautomer of the fluoroscein skeleton.