nitroglycerin (CHEBI:28787)

Main

Automatic Xrefs

Substructure Search Similarity Search Identity Search
Molfile

ChEBI Name	nitroglycerin

ChEBI ID	CHEBI:28787

Last Modified	18 October 2009

Stars	This entity has been manually annotated by the ChEBI Team.

Secondary ChEBI IDs	CHEBI:25559, CHEBI:137493, CHEBI:7595

Image

Applet

more structures >>

InChI

InChI=1/C3H5N3O9/c7-4(8)13-1-3(15-6(11)12)2-14-5(9)10/h3H,1-2H2

InChIKey

InChIKey=SNIOPGDIGTZGOP-UHFFFAOYAR

SMILES

O=N(=O)OCC(CON(=O)=O)ON(=O)=O

Formula	Source
C3H5N3O9	KEGG COMPOUND

Charge

Mass

227.08662

ChEBI Ontology
Tree view
Outgoing	nitroglycerin (CHEBI:28787) has role vasodilator agent (CHEBI:35620) nitroglycerin (CHEBI:28787) is a nitrate ester (CHEBI:51080) nitroglycerin (CHEBI:28787) has role nitric oxide donor (CHEBI:50566) nitroglycerin (CHEBI:28787) has role xenobiotic (CHEBI:35703)
Incoming	nitroglycerol (CHEBI:25560) is a nitroglycerin (CHEBI:28787)

IUPAC Name

1,2,3-trinitrooxypropane

Synonyms	Sources
1,2,3-propanetrioltrinitrate	UM-BBD
1,2,3-propanetriyl nitrate	NIST Chemistry WebBook
glycerin trinitrate	NIST Chemistry WebBook
glycerol trinitrate	NIST Chemistry WebBook
glycerol, nitric acid triester	NIST Chemistry WebBook
Glyceryl trinitrate	KEGG COMPOUND
NG	NIST Chemistry WebBook
Nitroglycerin	KEGG COMPOUND
nitroglycerine	NIST Chemistry WebBook
nitroglycerol	NIST Chemistry WebBook
Nitrostat	DrugBank
propane-1,2,3-triyl trinitrate	IUPAC
trinitroglycerin	UM-BBD
trinitroglycerol	NIST Chemistry WebBook