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ChEBI
> Main
CHEBI:52798 - ATTO 590
para
-isomer(1+)
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ChEBI Name
ATTO 590
para
-isomer(1+)
ChEBI ID
CHEBI:52798
ChEBI ASCII Name
ATTO 590 para-isomer(1+)
Definition
The
para
-isomer of ATTO 590 cation.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C36H37N2O5
Net Charge
+1
Average Mass
577.68940
Monoisotopic Mass
577.26970
InChI
InChI=1S/C36H36N2O5/c1-
8-
37-
28-
17-
30-
26(14-
21(28)
12-
13-
35(37,4)
5)
32(25-
15-
22(33(39)
40)
10-
11-
23(25)
34(41)
42)
27-
16-
24-
20(3)
19-
36(6,7)
38(9-
2)
29(24)
18-
31(27)
43-
30/h10-
19H,8-
9H2,1-
7H3,(H-
,39,40,41,42)
/p+1
InChIKey
DTNVZBLKMGRFER-UHFFFAOYSA-O
SMILES
CCN1c2cc3Oc4cc5=[N+](CC)C(C)(C)C=Cc5cc4=C(c3cc2C(C)=CC1(C)C)c1cc(ccc1C(O)=O)C(O)=O
Roles Classification
Chemical Role
(s):
Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Br
o
nsted base).
(via
oxoacid
)
Application
(s):
fluorochrome
A fluorescent dye used to stain biological specimens.
dye
(via
xanthene dye
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
ATTO 590
para
-isomer(1+) (
CHEBI:52798
)
has role
fluorochrome (
CHEBI:51217
)
ATTO 590
para
-isomer(1+) (
CHEBI:52798
)
is a
dicarboxylic acid (
CHEBI:35692
)
ATTO 590
para
-isomer(1+) (
CHEBI:52798
)
is a
organic cation (
CHEBI:25697
)
ATTO 590
para
-isomer(1+) (
CHEBI:52798
)
is a
organic heteropentacyclic compound (
CHEBI:38164
)
ATTO 590
para
-isomer(1+) (
CHEBI:52798
)
is a
xanthene dye (
CHEBI:37929
)
Incoming
ATTO 590
para
-isomer (
CHEBI:51823
)
has part
ATTO 590
para
-isomer(1+) (
CHEBI:52798
)
IUPAC Name
6-
(2,5-
dicarboxyphenyl)-
1,11-
diethyl-
2,2,8,10,10-
pentamethyl-
10,11-
dihydro-
2
H
-
pyrano[3,2-
g
:5,6-
g
']diquinolin-
1-
ium
Last Modified
28 July 2009