CHEBI:135114 - pentrinitrol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name pentrinitrol
ChEBI ID CHEBI:135114
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C5H9N3O10
Net Charge 0
Average Mass 271.139
Monoisotopic Mass 271.02879
InChI InChI=1S/C5H9N3O10/c9-1-5(2-16-6(10)11,3-17-7(12)13)4-18-8(14)15/h9H,1-4H2
InChIKey BRBAEHHXGZRCBK-UHFFFAOYSA-N
SMILES C(CO[N+]([O-])=O)(CO[N+]([O-])=O)(CO[N+]([O-])=O)CO
ChEBI Ontology
Outgoing pentrinitrol (CHEBI:135114) is a nitrate ester (CHEBI:51080)
Synonyms Sources
pentaerythritol trinitrate UniProt
pentaerythritol trinitrate DrugCentral
pentaerythrityl trinitrate DrugCentral
petrin DrugCentral
Manual Xref Database
3427 DrugCentral
View more database links
Registry Number Type Source
1607-17-6 CAS Registry Number DrugCentral
Last Modified
24 May 2024