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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:pentaerythritol tetranitrate
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Accession:CHEBI:25879 term browser browse the term
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.
Synonyms:related_synonym: 1,3-dinitrato-2,2-bis(nitratomethyl)propane;   2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate;   2,2-bis((nitrooxy)methyl)-1,3-propanediol dinitrate ester;   2,2-bis(hydroxymethyl)-1,3-propanediol tetranitrate;   3-(nitrooxy)-2,2-bis[(nitrooxy)methyl]propyl nitrate;   Formula=C5H8N4O12;   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;   InChIKey=TZRXHJWUDPFEEY-UHFFFAOYSA-N;   PENT;   PETN;   SMILES=[O-][N+](=O)OCC(CO[N+]([O-])=O)(CO[N+]([O-])=O)CO[N+]([O-])=O;   TEN;   corpent;   neopentanetetrayl nitrate;   nitropenta;   nitropentaerythrite;   nitropentaerythritol;   pentaerithrityl tetranitrate;   pentaerithrityli tetranitras;   pentaerythritylium tetranitricum;   penthrite;   tetranitrate de pentaerithrityle;   tetranitrato de pentaeritritilo;   tetranitropentaerythritol
 alt_id: CHEBI:31976
 xref: CAS:78-11-5;   Drug_Central:2087;   KEGG:D01721
 xref_mesh: MESH:D010417
 xref: Reaxys:1716886;   Wikipedia:Pentaerythritol_tetranitrate


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pentaerythritol tetranitrate term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Aldh2 aldehyde dehydrogenase 2 family member multiple interactions
increases metabolic processing
increases response to substance
ISO
EXP
[ALDH2 protein affects the metabolism of and results in increased susceptibility to Pentaerythritol Tetranitrate] which results in increased abundance of Nitric Oxide; [ALDH2 protein results in increased metabolism of Pentaerythritol Tetranitrate] which results in increased chemical synthesis of pentrinitrol
ALDH2 protein affects the metabolism of and results in increased activity of Pentaerythritol Tetranitrate
ALDH2 protein results in increased susceptibility to Pentaerythritol Tetranitrate
CTD PMID:15331769 PMID:21156756 NCBI chr12:40,466,418...40,498,813
Ensembl chr12:40,466,495...40,498,752
JBrowse link
G Fth1 ferritin heavy chain 1 increases expression ISO Pentaerythritol Tetranitrate results in increased expression of FTH1 mRNA CTD PMID:17641250 NCBI chr 1:226,030,940...226,033,228
Ensembl chr 1:226,030,938...226,033,228
JBrowse link
G Hmox1 heme oxygenase 1 increases expression
increases activity
ISO
EXP
Pentaerythritol Tetranitrate results in increased expression of HMOX1 mRNA
Pentaerythritol Tetranitrate results in increased activity of HMOX1 protein
Pentaerythritol Tetranitrate results in increased expression of HMOX1 mRNA; Pentaerythritol Tetranitrate results in increased expression of HMOX1 protein
CTD PMID:17092343 PMID:17541025 PMID:17641250 NCBI chr19:14,508,634...14,515,455
Ensembl chr19:14,508,616...14,515,456
JBrowse link
G Nos3 nitric oxide synthase 3 increases expression EXP Pentaerythritol Tetranitrate results in increased expression of NOS3 protein CTD PMID:17541025 NCBI chr 4:7,321,908...7,342,404
Ensembl chr 4:7,320,668...7,342,410
JBrowse link
G Vasp vasodilator-stimulated phosphoprotein multiple interactions
increases phosphorylation
EXP Benomyl inhibits the reaction [Pentaerythritol Tetranitrate results in increased phosphorylation of VASP protein] CTD PMID:15331769 PMID:17541025 NCBI chr 1:80,170,608...80,185,882
Ensembl chr 1:80,170,619...80,185,882
JBrowse link

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  CHEBI ontology 19771
    role 19716
      chemical role 19256
        explosive 4589
          pentaerythritol tetranitrate 5
Path 2
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  CHEBI ontology 19771
    subatomic particle 19770
      composite particle 19770
        hadron 19770
          baryon 19770
            nucleon 19770
              atomic nucleus 19770
                atom 19770
                  main group element atom 19658
                    p-block element atom 19658
                      chalcogen 19387
                        oxygen atom 19350
                          oxygen molecular entity 19350
                            hydroxides 19076
                              oxoacid 18275
                                pnictogen oxoacid 10312
                                  nitrogen oxoacid 275
                                    nitric acid 204
                                      nitrates 197
                                        nitrate ester 152
                                          pentaerythritol nitrate 5
                                            pentaerythritol tetranitrate 5
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