CHEBI:90122 - 5-CM-H2DCFDA

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ChEBI Name 5-CM-H2DCFDA
ChEBI ID CHEBI:90122
ChEBI ASCII Name 5-CM-H2DCFDA
Definition A member of the class of xanthenes that is the acetic anhydride of dihydrofluorescein diacetate carrying additional chloro substituents at positions 2 and 7 as well as a chloromethyl substituent meta to the anhydride function.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C27H19Cl3O8
Net Charge 0
Average Mass 577.795
Monoisotopic Mass 576.01455
InChI InChI=1S/C27H19Cl3O8/c1-12(31)35-24-9-22-18(7-20(24)29)26(19-8-21(30)25(36-13(2)32)10-23(19)38-22)16-5-4-15(11-28)6-17(16)27(34)37-14(3)33/h4-10,26H,11H2,1-3H3
InChIKey MGBKFIKRHPXEGN-UHFFFAOYSA-N
SMILES C1(=CC=C(C=C1C(OC(=O)C)=O)CCl)C2C=3C=C(C(=CC3OC=4C=C(C(=CC24)Cl)OC(=O)C)OC(=O)C)Cl
ChEBI Ontology
Outgoing 5-CM-H2DCFDA (CHEBI:90122) has functional parent fluorescein (lactone form) (CHEBI:31624)
5-CM-H2DCFDA (CHEBI:90122) is a acetate ester (CHEBI:47622)
5-CM-H2DCFDA (CHEBI:90122) is a acyclic carboxylic anhydride (CHEBI:36631)
5-CM-H2DCFDA (CHEBI:90122) is a organochlorine compound (CHEBI:36683)
5-CM-H2DCFDA (CHEBI:90122) is a xanthenes (CHEBI:38835)
Incoming 5(6)-CM-H2DCFDA (CHEBI:90121) has part 5-CM-H2DCFDA (CHEBI:90122)
IUPAC Name
acetic 2-[3,6-bis(acetyloxy)-2,7-dichloro-9H-xanthen-9-yl]-5-(chloromethyl)benzoic anhydride
Synonym Source
5-chloromethyl-2',7'-dichlorodihydrofluorescein diacetate, acetyl ester ChEBI
Last Modified
28 October 2015