CHEBI:51891 - BODIPY TMR-X

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ChEBI Name BODIPY TMR-X ChEBI ID CHEBI:51891 Stars This entity has been manually annotated by the ChEBI Team. 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 C31H35BF2N4O6 Net Charge 0 Average Mass 608.44077 Monoisotopic Mass 608.26177 InChI InChI=1S/C31H35BF2N4O6/c1-20-25(13-15-28(39)35-18-6-4-5-7-31(42)44-38-29(40)16-17-30(38)41)21(2)36-27(20)19-23-10-14-26(37(23)32(36,33)34)22-8-11-24(43-3)12-9-22/h8-12,14,19H,4-7,13,15-18H2,1-3H3,(H,35,39) InChIKey GRDQURHVJJVDRY-UHFFFAOYSA-N SMILES COc1ccc(cc1)-c1ccc2C=C3C(C)=C(CCC(=O)NCCCCCC(=O)ON4C(=O)CCC4=O)C(C)=[N+]3[B-](F)(F)n12 Roles Classification Application(s): fluorochrome A fluorescent dye used to stain biological specimens. dye (via BODIPY dye ) View more via ChEBI Ontology ChEBI Ontology Outgoing BODIPY TMR-X (CHEBI:51891) has functional parent 4,4-difluoro-4-bora-3a,4a-diaza-s-indacene (CHEBI:51107) BODIPY TMR-X (CHEBI:51891) has role fluorochrome (CHEBI:51217) BODIPY TMR-X (CHEBI:51891) is a BODIPY dye (CHEBI:51123) BODIPY TMR-X (CHEBI:51891) is a pyrrolidinone (CHEBI:38275) IUPAC Name [N-{6-[(2,5-dioxopyrrolidin-1-yl)oxy]-6-oxohexyl}-3-(2-{[5-(4-methoxyphenyl)-1H-pyrrol-2-yl-κN]methylene}-3,5-dimethyl-2H-pyrrol-4-yl-κN)propanamidato](difluoro)boron Synonym Source 6-((4,4-difluoro-1,3-dimethyl-5-(4-methoxyphenyl)-4- bora-3a,4a-diaza-s-indacene-2-propionyl)amino)hexanoic acid, succinimidyl ester ChEBI Last Modified 03 July 2009