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ChEBI
> Main
CHEBI:51935 - BODIPY TR methyl ester
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ChEBI Ontology
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ChEBI Name
BODIPY TR methyl ester
ChEBI ID
CHEBI:51935
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C22H17BF2N2O3S
Net Charge
0
Average Mass
438.25500
Monoisotopic Mass
438.10210
InChI
InChI=1S/C22H17BF2N2O3S/c1-
29-
22(28)
14-
30-
18-
8-
4-
15(5-
9-
18)
19-
10-
6-
16-
13-
17-
7-
11-
20(21-
3-
2-
12-
31-
21)
27(17)
23(24,25)
26(16)
19/h2-
13H,14H2,1H3
InChIKey
HQMDVGPFFTVIIE-UHFFFAOYSA-N
SMILES
COC(=O)COc1ccc(cc1)C1=[N+]2C(C=C1)=Cc1ccc(-c3cccs3)n1[B-]2(F)F
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 TR methyl ester (
CHEBI:51935
)
has functional parent
4,4-difluoro-4-bora-3a,4a-diaza-
s
-indacene (
CHEBI:51107
)
BODIPY TR methyl ester (
CHEBI:51935
)
has role
fluorochrome (
CHEBI:51217
)
BODIPY TR methyl ester (
CHEBI:51935
)
is a
BODIPY dye (
CHEBI:51123
)
BODIPY TR methyl ester (
CHEBI:51935
)
is a
methyl ester (
CHEBI:25248
)
IUPAC Name
difluoro{methyl [4-
(2-
{[5-
(thiophen-
2-
yl)-
1
H
-
pyrrol-
2-
yl-
κ
N
]methylene}-
2
H
-
pyrrol-
5-
yl-
κ
N
)phenoxy]acetatato}boron
Synonym
Source
CellTrace BODIPY TR methyl ester
ChEBI
Last Modified
03 March 2015