PD-156707   Click here for help

GtoPdb Ligand ID: 999

Synonyms: PD 156707 | PD156707
Compound class: Synthetic organic
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2D Structure
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SMILES / InChI / InChIKey
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Canonical SMILES COc1ccc(cc1)C(=O)C(=C(c1ccc2c(c1)OCO2)C(=O)[O-])Cc1cc(OC)c(c(c1)OC)OC.[Na+]
Isomeric SMILES COc1ccc(cc1)C(=O)/C(=C(/c1ccc2c(c1)OCO2)\C(=O)[O-])/Cc1cc(OC)c(c(c1)OC)OC.[Na+]
InChI InChI=1S/C28H26O9.Na/c1-32-19-8-5-17(6-9-19)26(29)20(11-16-12-23(33-2)27(35-4)24(13-16)34-3)25(28(30)31)18-7-10-21-22(14-18)37-15-36-21;/h5-10,12-14H,11,15H2,1-4H3,(H,30,31);/q;+1/p-1/b25-20-;
InChI Key ZLHQEGFYBMZQGM-RKVLWQGQSA-M
References
1. Maguire JJ, Kuc RE, Davenport AP. (1997)
Affinity and selectivity of PD156707, a novel nonpeptide endothelin antagonist, for human ET(A) and ET(B) receptors.
J Pharmacol Exp Ther, 280 (2): 1102-8. [PMID:9023329]
2. Pierre LN, Davenport AP. (1999)
Blockade and reversal of endothelin-induced constriction in pial arteries from human brain.
Stroke, 30 (3): 638-43. [PMID:10066864]