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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:51816 - ATTO 565
meta
-isomer
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ChEBI Ontology
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ChEBI Name
ATTO 565
meta
-isomer
ChEBI ID
CHEBI:51816
ChEBI ASCII Name
ATTO 565 meta-isomer
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C31H31ClN2O9
Net Charge
0
Average Mass
611.03862
Monoisotopic Mass
610.17181
InChI
InChI=1S/C31H30N2O5.ClHO4/c1-
3-
32-
11-
5-
7-
18-
13-
23-
27(16-
25(18)
32)
38-
28-
17-
26-
19(8-
6-
12-
33(26)
4-
2)
14-
24(28)
29(23)
21-
10-
9-
20(30(34)
35)
15-
22(21)
31(36)
37;2-
1(3,4)
5/h9-
10,13-
17H,3-
8,11-
12H2,1-
2H3,(H-
,34,35,36,37)
;(H,2,3,4,5)
InChIKey
WPKCJVLZWQTZOT-UHFFFAOYSA-N
SMILES
[O-]Cl(=O)(=O)=O.CCN1CCCc2cc3c(Oc4cc5=[N+](CC)CCCc5cc4=C3c3ccc(cc3C(O)=O)C(O)=O)cc12
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.
(via
ATTO 565
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
ATTO 565
meta
-isomer (
CHEBI:51816
)
has part
ATTO 565
meta
-isomer(1+) (
CHEBI:52796
)
ATTO 565
meta
-isomer (
CHEBI:51816
)
has role
fluorochrome (
CHEBI:51217
)
ATTO 565
meta
-isomer (
CHEBI:51816
)
is a
ATTO 565 (
CHEBI:51819
)
IUPAC Name
6-
(2,4-
dicarboxyphenyl)-
1,11-
diethyl-
3,4,8,9,10,11-
hexahydro-
2
H
-
pyrano[3,2-
g
:5,6-
g
']diquinolin-
1-
ium perchlorate
Synonym
Source
ATTO 565 free 2,4-dicarboxylic acid
ChEBI
Last Modified
23 July 2009