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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	UNII-B5J9G2N18M
Molecular formula	C22H38O5
IUPAC name	(Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]hept-5-enoic acid
Molecular weight	382.541
Hydrogen bond acceptor	5
Hydrogen bond donor	4
XlogP	3.6
Synonyms	SR-01000946501-1 16,16-Dimethyl-pgf2alpha B5J9G2N18M CHEMBL40183 ZINC29323758 (Z)-7-[(1R,2R,3R,5S)-3,5-dihydroxy-2-[(E,3R)-3-hydroxy-4,4-dimethyloct-1-enyl]cyclopentyl]hept-5-enoic acid 39746-23-1 SCHEMBL3366405 16,16-dimethyl PGF2alpha 9.alpha.,11.alpha.,15R-Trihydroxy-16,16-dimethyl-prosta-5Z,13E-dien-1-oic acid (5Z,9alpha,11alpha,13E,15S)-9,11,15-Trihydroxy-16,16-dimethylprosta-5,13-dien-1-oic acid 16,16-Dimethylprostaglandin F2.alpha. BDBM50090136 HMS3648F22 1253AH SR-01000946501 16,16-Dimethyl prostaglandin F2alpha AC1O5VMB YMRWVEHSLXJOCD-SCOYTADVSA-N (Z)-7-[(1R,2R,3R,5S)-3,5-Dihydroxy-2-((E)-(R)-3-hydroxy-4,4-dimethyl-oct-1-enyl)-cyclopentyl]-hept-5-enoic acid 16,16-Dimethylprostaglandin F2alpha MolPort-027-640-946 16,16-Dimethyl PGF2 alpha 7-[(1R,2R,4S,5R)-3,5-Dihydroxy-2-((E)-(R)-3-hydroxy-4,4-dimethyl-oct-1-enyl)-cyclopentyl]-hept-5-enoic acid [ Show all ]
Inchi Key	YMRWVEHSLXJOCD-SCOYTADVSA-N
Inchi ID	InChI=1S/C22H38O5/c1-4-5-14-22(2,3)20(25)13-12-17-16(18(23)15-19(17)24)10-8-6-7-9-11-21(26)27/h6,8,12-13,16-20,23-25H,4-5,7,9-11,14-15H2,1-3H3,(H,26,27)/b8-6-,13-12+/t16-,17-,18+,19-,20-/m1/s1
PubChem CID	6441607
ChEMBL	CHEMBL40183
IUPHAR	N/A
BindingDB	50090136
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
413910	Prostaglandin E2 receptor EP1 subtype	P34995	PTGER1	Homo sapiens (Human)	402
413911	Prostaglandin E2 receptor EP3 subtype	P43115	PTGER3	Homo sapiens (Human)	390
413908	Prostaglandin F2-alpha receptor	P43088	PTGFR	Homo sapiens (Human)	359
413907	Thromboxane A2 receptor	P21731	TBXA2R	Homo sapiens (Human)	343
413909	Thromboxane A2 receptor	P30987	Tbxa2r	Mus musculus (Mouse)	341

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