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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:51899 - C5-oxacyanine
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ChEBI Ontology
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ChEBI Name
C5-oxacyanine
ChEBI ID
CHEBI:51899
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C23H23IN2O2
Net Charge
0
Average Mass
486.34540
Monoisotopic Mass
486.08042
InChI
InChI=1S/C23H23N2O2.HI/c1-
3-
24-
18-
12-
8-
10-
14-
20(18)
26-
22(24)
16-
6-
5-
7-
17-
23-
25(4-
2)
19-
13-
9-
11-
15-
21(19)
27-
23;/h5-
17H,3-
4H2,1-
2H3;1H/q+1;/p-
1
InChIKey
CLDZYSUDOQXJOU-UHFFFAOYSA-M
SMILES
[I-].[H]C(=CC([H])=C1Oc2ccccc2N1CC)C([H])=Cc1oc2ccccc2[n+]1CC
Roles Classification
Application
(s):
fluorochrome
A fluorescent dye used to stain biological specimens.
dye
(via
cyanine dye
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
C5-oxacyanine (
CHEBI:51899
)
has part
C5-oxacyanine cation (
CHEBI:52805
)
C5-oxacyanine (
CHEBI:51899
)
has role
fluorochrome (
CHEBI:51217
)
C5-oxacyanine (
CHEBI:51899
)
is a
1,3-benzoxazoles (
CHEBI:51548
)
C5-oxacyanine (
CHEBI:51899
)
is a
cyanine dye (
CHEBI:37960
)
C5-oxacyanine (
CHEBI:51899
)
is a
organic iodide salt (
CHEBI:50356
)
IUPAC Name
3-
ethyl-
2-
[5-
(3-
ethyl-
1,3-
benzoxazol-
2(3
H
)-
ylidene)penta-
1,3-
dien-
1-
yl]-
1,3-
benzoxazol-
3-
ium iodide
Synonym
Source
Oxadicarbocyanine (C5) dye
ChEBI
Last Modified
17 October 2009