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ChEBI
> Main
CHEBI:51249 - Alexa Fluor 594
meta
-isomer
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ChEBI Name
Alexa Fluor 594
meta
-isomer
ChEBI ID
CHEBI:51249
ChEBI ASCII Name
Alexa Fluor 594 meta-isomer
Definition
The 5-succinimidyloxycarbonyl isomer of Alexa Fluor 594.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C39H37N3O13S2
Net Charge
0
Average Mass
819.85550
Monoisotopic Mass
819.17678
InChI
InChI=1S/C39H37N3O13S2/c1-
38(2)
16-
21(18-
56(48,49)
50)
24-
12-
27-
31(14-
29(24)
40(38)
5)
54-
32-
15-
30-
25(22(19-
57(51,52)
53)
17-
39(3,4)
41(30)
6)
13-
28(32)
35(27)
23-
8-
7-
20(11-
26(23)
36(45)
46)
37(47)
55-
42-
33(43)
9-
10-
34(42)
44/h7-
8,11-
17H,9-
10,18-
19H2,1-
6H3,(H2-
,45,46,48,49,50,51,52,53)
InChIKey
KWHCBZDWVYWWLE-UHFFFAOYSA-N
SMILES
CN1c2cc3Oc4cc5=[N+]
(C)
C(C)
(C)
C=C(CS([O-
]
)
(=O)
=O)
c5cc4=C(c3cc2C(CS(O)
(=O)
=O)
=CC1(C)
C)
c1ccc(cc1C(O)
=O)
C(=O)
ON1C(=O)
CCC1=O
Roles Classification
Application
(s):
fluorochrome
A fluorescent dye used to stain biological specimens.
(via
Alexa Fluor 594
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
Alexa Fluor 594
meta
-isomer (
CHEBI:51249
)
is a
Alexa Fluor 594 (
CHEBI:51248
)
IUPAC Name
[6-
(2-
carboxy-
4-
{[(2,5-
dioxopyrrolidin-
1-
yl)oxy]carbonyl}phenyl)-
1,2,2,10,10,11-
hexamethyl-
8-
(sulfomethyl)-
10,11-
dihydro-
2
H
-
pyrano[3,2-
g
:5,6-
g
']diquinolin-
1-
ium-
4-
yl]methanesulfonate
Last Modified
10 August 2009
General Comment
2009-07-08
The numbering of the 5-succinimidyloxycarbonyl substituent on the phenyl ring is based upon the numbering of the ring-closed lactone tautomer of the fluoroscein skeleton.