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Ligand

Namecarbacyclin
Molecular formulaC21H34O4
IUPAC name(5Z)-5-[(3aS,4R,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxyoct-1-enyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoic acid
Molecular weight350.499
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP3.2
Synonyms(5Z)-5-[(3aS,4R,5R,6aS)-5-hydroxy-4-[(E,3S)-3-hydroxyoct-1-enyl]-3,3a,4,5,6,6a-hexahydro-1H-pentalen-2-ylidene]pentanoic acid
1661AH
5-cis-Carbaprostacyclin
5-[(3aS,4R,5R,6aS)-5-Hydroxy-4-((S)-3-hydroxy-oct-1-enyl)-hexahydro-pentalen-(2Z)-ylidene]-pentanoic acid
5-[5-Hydroxy-4-(3-hydroxy-oct-1-enyl)-hexahydro-pentalen-2-ylidene]-pentanoic acidCarbacyclin
[ Show all ]
Inchi KeyXZFRIPGNUQRGPI-WLPVIMDJSA-N
Inchi IDInChI=1S/C21H34O4/c1-2-3-4-8-17(22)10-11-18-19-13-15(7-5-6-9-21(24)25)12-16(19)14-20(18)23/h7,10-11,16-20,22-23H,2-6,8-9,12-14H2,1H3,(H,24,25)/b11-10+,15-7-/t16-,17-,18+,19-,20+/m0/s1
PubChem CID5311242
ChEMBLN/A
IUPHAR1893
BindingDB50109546
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 14
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
404473Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
555293Prostacyclin receptorP43252PtgirMus musculus (Mouse)415
555295Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
404476Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402
404469Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
404472Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358
404479Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390
555294Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
404474Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513
404477Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488
404470Prostaglandin F2-alpha receptorP43117PtgfrMus musculus (Mouse)366
404475Prostaglandin F2-alpha receptorP37289PTGFRBos taurus (Bovine)362
404478Prostaglandin F2-alpha receptorP43088PTGFRHomo sapiens (Human)359
555292Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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