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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:51491 - cascade yellow
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ChEBI Ontology
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ChEBI Name
cascade yellow
ChEBI ID
CHEBI:51491
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C27H21N3O9S
Net Charge
0
Average Mass
563.53646
Monoisotopic Mass
563.09985
InChI
InChI=1S/C27H21N3O9S/c1-
37-
21-
6-
5-
19(14-
23(21)
40(34,35)
36)
22-
15-
28-
26(38-
22)
18-
9-
11-
29(12-
10-
18)
16-
17-
3-
2-
4-
20(13-
17)
27(33)
39-
30-
24(31)
7-
8-
25(30)
32/h2-
6,9-
15H,7-
8,16H2,1H3
InChIKey
PTIUZRZHZRYCJE-UHFFFAOYSA-N
SMILES
COc1ccc(cc1S([O-])(=O)=O)-c1cnc(o1)-c1cc[n+](Cc2cccc(c2)C(=O)ON2C(=O)CCC2=O)cc1
Roles Classification
Application
(s):
fluorochrome
A fluorescent dye used to stain biological specimens.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
cascade yellow (
CHEBI:51491
)
has role
fluorochrome (
CHEBI:51217
)
cascade yellow (
CHEBI:51491
)
is a
1,3-oxazoles (
CHEBI:46812
)
cascade yellow (
CHEBI:51491
)
is a
arenesulfonate oxoanion (
CHEBI:22713
)
cascade yellow (
CHEBI:51491
)
is a
pyridinium ion (
CHEBI:50334
)
cascade yellow (
CHEBI:51491
)
is a
pyrrolidinone (
CHEBI:38275
)
IUPAC Name
5-
{2-
[1-
(3-
{[(2,5-
dioxopyrrolidin-
1-
yl)oxy]carbonyl}benzyl)pyridinium-
4-
yl]-
1,3-
oxazol-
5-
yl}-
2-
methoxybenzenesulfonate
Last Modified
24 July 2009