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Chemical Entities of Biological Interest Ontology
| Preferred Name | pentaerythritol tetranitrate | |
| Synonyms |
2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate neopentanetetrayl nitrate PETN tetranitropentaerythritol 1,3-dinitrato-2,2-bis(nitratomethyl)propane pentaerithrityl tetranitrate nitropentaerythritol penthrite tetranitrato de pentaeritritilo tetranitrate de pentaerithrityle TEN nitropentaerythrite pentaerythritylium tetranitricum 3-(nitrooxy)-2,2-bis[(nitrooxy)methyl]propyl nitrate 2,2-bis(hydroxymethyl)-1,3-propanediol tetranitrate 2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate ester nitropenta corpent PENT pentaerithrityli tetranitras pentaerythritol tetranitrate |
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| Definitions |
A pentaerythritol nitrate in which all four hydroxy groups of pentaerythritol have been converted to the corresponding nitrate ester. It is a vasodilator with properties similar to those of glyceryl trinitrate, but with a more prolonged duration of action, and is used for treatment of angina pectoris. It is also one of the most powerful high explosives known and is a component of the plastic explosive known as Semtex. |
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| ID |
http://purl.obolibrary.org/obo/CHEBI_25879 |
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| charge |
0
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| database_cross_reference |
Reaxys:1716886 CAS:78-11-5 Drug_Central:2087 KEGG:D01721 Wikipedia:Pentaerythritol_tetranitrate
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| definition |
A pentaerythritol nitrate in which all four hydroxy groups of pentaerythritol have been converted to the corresponding nitrate ester. It is a vasodilator with properties similar to those of glyceryl trinitrate, but with a more prolonged duration of action, and is used for treatment of angina pectoris. It is also one of the most powerful high explosives known and is a component of the plastic explosive known as Semtex.
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| formula |
C5H8N4O12
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| has role | ||
| has_alternative_id |
CHEBI:31976
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| has_exact_synonym |
pentaerythritol tetranitrate
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| has_obo_namespace |
chebi_ontology
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| has_related_synonym |
2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate neopentanetetrayl nitrate PETN tetranitropentaerythritol 1,3-dinitrato-2,2-bis(nitratomethyl)propane pentaerithrityl tetranitrate nitropentaerythritol penthrite tetranitrato de pentaeritritilo tetranitrate de pentaerithrityle TEN nitropentaerythrite pentaerythritylium tetranitricum 3-(nitrooxy)-2,2-bis[(nitrooxy)methyl]propyl nitrate 2,2-bis(hydroxymethyl)-1,3-propanediol tetranitrate 2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate ester nitropenta corpent PENT pentaerithrityli tetranitras
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| id |
CHEBI:25879
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| in_subset | ||
| inchi |
InChI=1S/C5H8N4O12/c10-6(11)18-1-5(2-19-7(12)13,3-20-8(14)15)4-21-9(16)17/h1-4H2
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| inchikey |
TZRXHJWUDPFEEY-UHFFFAOYSA-N
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| label |
pentaerythritol tetranitrate
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| mass |
316.13660
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| monoisotopicmass |
316.01387
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| notation |
CHEBI:25879
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| prefLabel |
pentaerythritol tetranitrate
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| smiles |
[O-][N+](=O)OCC(CO[N+]([O-])=O)(CO[N+]([O-])=O)CO[N+]([O-])=O
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| treeView | ||
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