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ChEBI
> Main
CHEBI:53730 - remazole orange-3R
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ChEBI Ontology
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ChEBI Name
remazole orange-3R
ChEBI ID
CHEBI:53730
Definition
An azo compound having a ({[(2-sulfonatooxy)ethyl]sulfonyl}phenyl)diazenyl moiety attached at position 2 of a multi-substituted naphthalene.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C20H17N3Na2O11S3
Net Charge
0
Average Mass
617.53700
Monoisotopic Mass
616.98206
InChI
InChI=1S/C20H19N3O11S3.2Na/c1-
12(24)
21-
15-
3-
2-
13-
10-
18(36(28,29)
30)
19(20(25)
17(13)
11-
15)
23-
22-
14-
4-
6-
16(7-
5-
14)
35(26,27)
9-
8-
34-
37(31,32)
33;;/h2-
7,10-
11,25H,8-
9H2,1H3,(H,21,24)
(H,28,29,30)
(H,31,32,33)
;;/q;2*+1/p-
2/b23-
22+;;
InChIKey
DHHGSXPASZBLGC-VPMNAVQSSA-L
SMILES
[Na+].[Na+].CC(=O)Nc1ccc2cc(c(\N=N\c3ccc(cc3)S(=O)(=O)CCOS([O-])(=O)=O)c(O)c2c1)S([O-])(=O)=O
Roles Classification
Application
(s):
dye
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
remazole orange-3R (
CHEBI:53730
)
has part
remazole orange-3R(2−) (
CHEBI:53733
)
remazole orange-3R (
CHEBI:53730
)
has role
dye (
CHEBI:37958
)
remazole orange-3R (
CHEBI:53730
)
is a
monoazo compound (
CHEBI:48959
)
remazole orange-3R (
CHEBI:53730
)
is a
organic sodium salt (
CHEBI:38700
)
remazole orange-3R (
CHEBI:53730
)
is a
sulfone (
CHEBI:35850
)
IUPAC Name
disodium 6-
acetamido-
4-
hydroxy-
3-
[(4-
{[2-
(sulfonatooxy)ethyl]sulfonyl}phenyl)diazenyl]naphthalene-
2-
sulfonate
Synonyms
Sources
Brilliant orange 3R
ChemIDplus
Reactive orange 16
ChEBI
Reactive Orange 4
ChEBI
Remazol Brilliant Orange 3R
ChEBI
Remazol Orange G
ChEBI
Registry Numbers
Types
Sources
20262-58-2
CAS Registry Number
ChemIDplus
8819776
Reaxys Registry Number
Reaxys
Citations
Types
Sources
11696055
PubMed citation
Europe PMC
16758470
PubMed citation
Europe PMC
19345978
PubMed citation
Europe PMC
19647934
PubMed citation
Europe PMC
19733965
PubMed citation
Europe PMC
22531430
PubMed citation
Europe PMC
24360991
PubMed citation
Europe PMC
Last Modified
25 August 2023