CHEBI:77327 - CL-20

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ChEBI Name CL-20 ChEBI ID CHEBI:77327 Definition A polycyclic cage that is hexaazaisowurtzitane in which all six amino hydrogens are replaced by nitro groups. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C6H6N12O12 Net Charge 0 Average Mass 438.18500 Monoisotopic Mass 438.02281 InChI InChI=1S/C6H6N12O12/c19-13(20)7-1-2-8(14(21)22)5(7)6-9(15(23)24)3(11(1)17(27)28)4(10(6)16(25)26)12(2)18(29)30/h1-6H InChIKey NDYLCHGXSQOGMS-UHFFFAOYSA-N SMILES [O-][N+](=O)N1C2C3N(C4C(N3[N+]([O-])=O)N(C(C1N4[N+]([O-])=O)N2[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O Roles Classification Chemical Role(s): explosive A substance capable of undergoing rapid and highly exothermic decomposition. View more via ChEBI Ontology ChEBI Ontology Outgoing CL-20 (CHEBI:77327) has role explosive (CHEBI:63490) CL-20 (CHEBI:77327) is a N-nitro compound (CHEBI:38780) CL-20 (CHEBI:77327) is a polycyclic cage (CHEBI:33640) IUPAC Name 1,3,4,7,8,10-hexanitrooctahydro-1H-5,2,6-(epiminomethanetriylimino)imidazo[4,5-b]pyrazine Synonyms Sources Hexanitrohexaazaisowurtzitane ChemIDplus HNIW ChemIDplus Octahydro-1,3,4,7,8,10-hexanitro-5,2,6-(iminomethenimino)-1H-imidazo(4,5-b)pyrazine ChemIDplus Manual Xref Database Hexanitrohexaazaisowurtzitane Wikipedia View more database links Registry Numbers Types Sources 135285-90-4 CAS Registry Number ChemIDplus 4834707 Reaxys Registry Number Reaxys Citations Types Sources 22191394 PubMed citation Europe PMC 23136867 PubMed citation Europe PMC Last Modified 17 February 2014