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,
InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:51945 - DY-630
Main
ChEBI Ontology
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ChEBI Name
DY-630
ChEBI ID
CHEBI:51945
Stars
This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download
Molfile
XML
SDF
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Molfile
Formula
C36H46N2O6S
Net Charge
0
Average Mass
634.82632
Monoisotopic Mass
634.30766
InChI
InChI=1S/C36H46N2O6S/c1-
8-
37(9-
2)
26-
17-
19-
28-
25(22-
33(35(3,4)
5)
44-
31(28)
23-
26)
14-
13-
15-
32-
36(6,7)
29-
24-
27(45(41,42)
43)
18-
20-
30(29)
38(32)
21-
12-
10-
11-
16-
34(39)
40/h13-
15,17-
20,22-
24H,8-
12,16,21H2,1-
7H3,(H-
,39,40,41,42,43)
InChIKey
ZMSXTBKPLVKZPZ-UHFFFAOYSA-N
SMILES
[H]
C(=C([H]
)
c1cc([o+]
c2cc(ccc12)
N(CC)
CC)
C(C)
(C)
C)
C([H]
)
=C1N(CCCCCC(O)
=O)
c2ccc(cc2C1(C)
C)
S([O-
]
)
(=O)
=O
Roles Classification
Application
(s):
fluorochrome
A fluorescent dye used to stain biological specimens.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
DY-630 (
CHEBI:51945
)
has role
fluorochrome (
CHEBI:51217
)
DY-630 (
CHEBI:51945
)
is a
oxonium betaine (
CHEBI:51978
)
IUPAC Names
2-
{3-
[2-
tert-
butyl-
7-
(diethylamino)-
4
H
-
chromen-
4-
ylidene]prop-
1-
en-
1-
yl}-
1-
(5-
carboxypentyl)-
3,3-
dimethyl-
3
H
-
indolium-
5-
sulfonate
2-
{3-
[2-
t
ert-
butyl-
7-
(diethylamino)chromenium-
4-
yl]prop-
2-
en-
1-
ylidene}-
1-
(5-
carboxypentyl)-
3,3-
dimethylindoline-
5-
sulfonate
Last Modified
28 November 2011