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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	Esuberaprost
Molecular formula	C24H30O5
IUPAC name	4-[(1R,2R,3aS,8bS)-2-hydroxy-1-[(E,3S,4S)-3-hydroxy-4-methyloct-1-en-6-ynyl]-2,3,3a,8b-tetrahydro-1H-cyclopenta[b][1]benzofuran-5-yl]butanoic acid
Molecular weight	398.499
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	3.2
Synonyms	(1R)-2,3,3abeta,8bbeta-Tetrahydro-2alpha-hydroxy-1beta-[(E,3S,4S)-3-hydroxy-4-methyl-1-octene-6-ynyl]-1H-cyclopenta[b]benzofuran-5-butyric acid APS-314D free acid GTPL8314 BPS-314D UNII-35E3NJJ4O6 component CTPOHARTNNSRSR-NOQAJONNSA-N APS 314D D10628 1H-Cyclopenta(b)benzofuran-5-butanoic acid, 2,3,3a,8b-tetrahydro-2-hydroxy-1-((1E,3S,4S)-3-hydroxy-4-methyl-1-octen-6-ynyl)-, (1R,2R,3aS,8bS)- Beraprost sodium 314D Esuberaprost (USAN/INN) SCHEMBL13174399 94132-88-4 CHEMBL3137314 ZINC13671573 (1R)-1beta-[(3S,4S)-3-Hydroxy-4-methyl-1-octene-6-yne-1-yl]-2alpha-hydroxy-2,3,3abeta,8bbeta-tetrahydro-1H-cyclopenta[b]benzofuran-5-butanoic acid APS-314D DTXSID00240666 1JSN1I7582 Beraprost, (+)- Esuberaprost [USAN:INN] UNII-1JSN1I7582 AKOS032946529 D0CO3N [ Show all ]
Inchi Key	CTPOHARTNNSRSR-NOQAJONNSA-N
Inchi ID	InChI=1S/C24H30O5/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)/b13-12+/t15-,17-,19+,20+,21-,23-/m0/s1
PubChem CID	10501053
ChEMBL	N/A
IUPHAR	8314
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
553480	Prostacyclin receptor	P43119	PTGIR	Homo sapiens (Human)	386

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