beraprost sodium (CHEBI:31270)

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CHEBI:31270 - beraprost sodium

ChEBI ID	CHEBI:31270
ChEBI Name	beraprost sodium
Stars
Definition	The organic sodium salt of beraprost. It is used in the treatment of chronic arterial occlusive disease and primary pulmonary hypertension in Japan.
Last Modified	30 September 2020
Downloads	Molfile

Formula	C24H29O5.Na
Net Charge	0
Average Mass	420.481
Monoisotopic Mass	420.19127
SMILES	[H][C@]12c3cccc(CCCC(=O)[O-])c3O[C@@]1([H])C[C@@H](O)[C@]2([H])/C=C/[C@@H](O)C(C)CC#CC.[Na+]
InChI	InChI=1S/C24H30O5.Na/c1-3-4-7-15(2)19(25)13-12-17-20(26)14-21-23(17)18-10-5-8-16(24(18)29-21)9-6-11-22(27)28;/h5,8,10,12-13,15,17,19-21,23,25-26H,6-7,9,11,14H2,1-2H3,(H,27,28);/q;+1/p-1/b13-12+;/t15?,17-,19+,20+,21-,23-;/m0./s1
InChIKey	YTCZZXIRLARSET-VJRSQJMHSA-M

Roles Classification

Biological Role:

prostaglandin receptor agonist An agonist that binds to and activates prostaglandin receptors.

Applications:

anti-inflammatory agent Any compound that has anti-inflammatory effects.

vasodilator agent A drug used to cause dilation of the blood vessels.

antihypertensive agent Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.

platelet aggregation inhibitor A drug or agent which antagonizes or impairs any mechanism leading to blood platelet aggregation, whether during the phases of activation and shape change or following the dense-granule release reaction and stimulation of the prostaglandin-thromboxane system.

ChEBI Ontology

Outgoing Relation(s)
	beraprost sodium (CHEBI:31270) has part beraprost(1−) (CHEBI:156557)
	beraprost sodium (CHEBI:31270) has role anti-inflammatory agent (CHEBI:67079)
	beraprost sodium (CHEBI:31270) has role antihypertensive agent (CHEBI:35674)
	beraprost sodium (CHEBI:31270) has role platelet aggregation inhibitor (CHEBI:50427)
	beraprost sodium (CHEBI:31270) has role prostaglandin receptor agonist (CHEBI:66900)
	beraprost sodium (CHEBI:31270) has role vasodilator agent (CHEBI:35620)
	beraprost sodium (CHEBI:31270) is a organic sodium salt (CHEBI:38700)

IUPAC Name
sodium 4-{(1R,2R,3aS,8bS)-2-hydroxy-1-[(1E,3S)-3-hydroxy-4-methyloct-1-en-6-yn-1-yl]-2,3,3a,8b-tetrahydro-1H-benzo[b]cyclopenta[d]furan-5-yl}butanoate

Synonyms	Source
beraprost sodium	KEGG COMPOUND
TRK-100	ChemIDplus
TRK 100	ChEBI
beraprost Na	ChEBI

Brand Names	Source
Procylin	KEGG COMPOUND
Berasil	ChEBI
Dorner	ChEBI
Berast	ChEBI
Prorner	ChEBI
Careload LA	ChEBI

Manual Xrefs	Databases
D01551	KEGG DRUG

Registry Numbers	Sources
CAS:88475-69-8	ChemIDplus

Citations