CHEBI:9505 - nitro blue tetrazolium dichloride

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ChEBI Name nitro blue tetrazolium dichloride
ChEBI ID CHEBI:9505
Definition An organic chloride salt having nitro blue tetrazolium(2+) as the counterion.
Stars This entity has been manually annotated by the ChEBI Team.
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Formulae C40H30Cl2N10O6
C40H30N10O6.2Cl
Net Charge 0
Average Mass 817.63600
Monoisotopic Mass 816.173
InChI InChI=1S/C40H30N10O6.2ClH/c1-55-37-25-29(13-23-35(37)47-43-39(27-9-5-3-6-10-27)41-45(47)31-15-19-33(20-16-31)49(51)52)30-14-24-36(38(26-30)56-2)48-44-40(28-11-7-4-8-12-28)42-46(48)32-17-21-34(22-18-32)50(53)54;;/h3-26H,1-2H3;2*1H/q+2;;/p-2
InChIKey FSVCQIDHPKZJSO-UHFFFAOYSA-L
SMILES [Cl-].[Cl-].COc1cc(ccc1-[n+]1nc(nn1-c1ccc(cc1)[N+]([O-])=O)-c1ccccc1)-c1ccc(c(OC)c1)-[n+]1nc(nn1-c1ccc(cc1)[N+]([O-])=O)-c1ccccc1
ChEBI Ontology
Outgoing nitro blue tetrazolium dichloride (CHEBI:9505) has part nitro blue tetrazolium(2+) (CHEBI:7586)
nitro blue tetrazolium dichloride (CHEBI:9505) is a organic chloride salt (CHEBI:36094)
IUPAC Name
3,3'-(3,3'-dimethoxy-[1,1'-biphenyl]-4,4'-diyl)bis[2-(4-nitrophenyl)-5-phenyl-2H-tetrazol-3-ium] dichloride
Synonyms Sources
2,2'-(3,3'-dimethoxy-[1,1'-biphenyl]-4,4'-diyl)bis[3-(4-nitrophenyl)-5-phenyl-2H-tetrazol-3-ium] dichloride IUPAC
3,3'-[3,3'-dimethoxy(1,1'-biphenyl)-4,4'-diyl]bis[2-(4-nitrophenyl)-5-phenyl-2H-tetrazolium] dichloride ChemIDplus
5,5'-diphenyl-3,3'-bis(4-nitrophenyl)-2,2'-(3,3'-dimethoxybiphenyl-4,4'-ylene)ditetrazolium dichloride ChemIDplus
NBT ChemIDplus
Nitro blue tetrazolium KEGG COMPOUND
Nitro Blue tetrazolium chloride ChemIDplus
Nitroblue tetrazolium chloride ChemIDplus
p-nitro blue tetrazolium chloride ChemIDplus
Database Links Databases
C13503 KEGG COMPOUND
D02003 KEGG DRUG
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Registry Numbers Types Sources
298-83-9 CAS Registry Number KEGG COMPOUND
298-83-9 CAS Registry Number ChemIDplus
4115923 Beilstein Registry Number Beilstein
Last Modified
08 January 2016