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1,8-Dihydroxy-4,5-dinitroanthraquinone

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Category Virus Protease
CAS 81-55-0
Description 1,8-Dihydroxy-4,5-dinitroanthraquinone is an NS2B-NS3 protease-specific inhibitor used in the treatment of dengue fever and West Nile virus infections.
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Product Information

Synonyms 81-55-0;1,8-DIHYDROXY-4,5-DINITROANTHRAQUINONE;4,5-Dinitrochrysazin;ARDP0006;1,8-Dinitro-4,5-dihydroxyanthraquinone;9,10-Anthracenedione, 1,8-dihydroxy-4,5-dinitro-;1,8-Dihydroxy-4,5-dinitroanthracene-9,10-dione;1,8-Dihydroxy-4,5-dinitro-9,10-anthracenedione;4,5-Dihydroxy-1,8-dinitroanthraquinone;NCI-C60742;9,10-Anthracenedione,1,8-dihydroxy-4,5-dinitro-;Anthraquinone, 1,8-dihydroxy-4,5-dinitro-;NSC 81256;Chrysazin, 4,5-dinitro-;HEO6302D6D;CHEMBL1535689;DTXSID0025076;NSC-81256;1,8-dihydroxy-4,5-dinitro-9,10-dihydroanthracene-9,10-dione;CCRIS 4796;1,8-Dihydroxy-4,5-dinitroanthra-9,10-quinone;EINECS 201-360-3;BRN 2182054;UNII-HEO6302D6D;1,8-Dihydroxy-4,5-dinitro Anthraquinone;AI3-62955;NSC81256;1,8-dihydroxy-4,5-dinitro-anthraquinone;4,8-dinitroanthraquinone;0-08-00-00460 (Beilstein Handbook Reference);SCHEMBL186885;DTXCID005076;9, 1,8-dihydroxy-4,5-dinitro-;Tox21_200725;BDBM50578686;AKOS015856377;4,5-dinitro-1,8-dihydroxyanthraquinone;Anthraquinone,8-dihydroxy-4,5-dinitro-;CAS-81-55-0;NCGC00091217-01;NCGC00091217-02;NCGC00091217-03;NCGC00091217-04;NCGC00258279-01;NCGC00258279-02;AC-11721;AS-67364;DB-056537;HY-121138;WLN: L C666 BVIVJ DQ GNW KNW NQ;CS-0079532;D2697;NS00038135;1,8-Dihydroxy-4,5-dinitroanthraquinone, 97%;D90099;1,8-Dihydroxy-4,5-dinitro-9,10-anthraquinone;1,8-Dihydroxy-4,5-dinitroanthra-9,10-quinone #;A840157;DIHYDROXY-4,5-DINITROANTHRAQUINONE, 1,8-;SR-01000323862;Q-200091;SR-01000323862-1;Q27279889;InChI=1/C14H6N2O8/c17-7-3-1-5(15(21)22)9-11(7)14(20)12-8(18)4-2-6(16(23)24)10(12)13(9)19/h1-4,17-18;
IUPAC Name 1,8-dihydroxy-4,5-dinitroanthracene-9,10-dione
Molecular Weight 463.6
Molecular Formula C24H25N5O3S
Canonical SMILES CC1CC2=CC=CC=C2N1S(=O)(=O)C3=CC=CC(=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5
InChI InChI=1S/C14H6N2O8/c17-7-3-1-5(15(21)22)9-11(7)14(20)12-8(18)4-2-6(16(23)24)10(12)13(9)19/h1-4,17-18H
InChIKey GJCHQJDEYFYWER-UHFFFAOYSA-N
Boiling Point 669.4±55.0°C at 760 mmHg
Melting Point >270°C (dec.)
Purity ≥95%
Density 1.838±0.06 g/cm3
Solubility Soluble in Dichloromethane (Very Slightly, Heated, Sonicated), DMSO (Slightly)
Appearance Solid
Storage Store at -20°C
Complexity 549
Exact Mass 330.01241515

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