guanethidine sulfate (CHEBI:51017)

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ChEBI Name	guanethidine sulfate

ChEBI ID	CHEBI:51017

Definition	A organic sulfate salt composed of two molecules of guanethidine and one of sulfuric acid.

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

Supplier Information

Download	Molfile XML SDF

Formula

(C10H22N4)2.H2SO4

Net Charge

Average Mass

494.69676

Monoisotopic Mass

494.33627

InChI

InChI=1S/2C10H22N4.H2O4S/c2*11-10(12)13-6-9-14-7-4-2-1-3-5-8-14;1-5(2,3)4/h2*1-9H2,(H4,11,12,13);(H2,1,2,3,4)

InChIKey

NBJGGHFXCGHTNJ-UHFFFAOYSA-N

SMILES

[H+].[H+].[O-]S([O-])(=O)=O.NC(=N)NCCN1CCCCCCC1.NC(=N)NCCN1CCCCCCC1

Roles Classification
Application(s):	antihypertensive agent Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.

ChEBI Ontology
Outgoing	guanethidine sulfate (CHEBI:51017) has part guanethidine monosulfate (CHEBI:51016) guanethidine sulfate (CHEBI:51017) has role antihypertensive agent (CHEBI:35674) guanethidine sulfate (CHEBI:51017) is a organic sulfate salt (CHEBI:51337)

IUPAC Name

bis(1-(2-azocan-1-ylethyl)guanidine) sulfate

Synonyms	Sources
(2-(Hexahydro-1(2H)-azocinyl)ethyl)guanidine sulfate (2:1)	ChemIDplus
Azocine, 1-(2-guanidinoethyl)octahydro-, sulfate (2:1)	ChEBI
beta-1-Azacyclooctylethylguanidine sulfate	ChemIDplus
Guanethidine bisulfate	ChemIDplus
Guanidine, (2-(hexahydro-1(2H)-azocinyl)ethyl)-, sulfate (2:1)	ChemIDplus
Guanidine, (2-(octahydro-1-azocinyl)ethyl)-, hemisulfate	ChemIDplus

Last Modified

01 December 2011