(Q27076730)

CHEMBL331048 (English)

3 October 2016

chemical formula

C₂₅H₂₅F₂N₂O₄⁻

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

CC(C)C1=C(N=C(N1C=CC(CC(CC(=O)[O-])O)O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

1 reference

CHEMBL331048 (English)

3 October 2016

isomeric SMILES

CC(C)C1=C(N=C(N1/C=C/[C@H](C[C@H](CC(=O)[O-])O)O)C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

1 reference

CHEMBL331048 (English)

InChI=1S/C25H26F2N2O4/c1-15(2)24-23(16-3-7-18(26)8-4-16)28-25(17-5-9-19(27)10-6-17)29(24)12-11-20(30)13-21(31)14-22(32)33/h3-12,15,20-21,30-31H,13-14H2,1-2H3,(H,32,33)/p-1/b12-11+/t20-,21-/m1/s1

3 October 2016

Identifiers

InChI

1 reference

CHEMBL331048 (English)

TVIKMEWXHYDWEQ-LKWCPCFXSA-M

3 October 2016

InChIKey

1 reference

CHEMBL331048 (English)

3 October 2016

1 reference

(3R,5S,6E)-7-[2,4-Bis(4-fluorophenyl)-5-isopropyl-1H-imidazol-1-yl]-3,5-dihydroxy-6-heptenoic acid (English)

3 October 2016

1 reference

IUPHAR/BPS Guide to PHARMACOLOGY

CHEMBL331048 (English)

3 October 2016

1 reference

8 February 2021

1 reference

Guide to Pharmacology Ligand ID

2994

1 reference

stated in

IUPHAR/BPS Guide to PHARMACOLOGY

Guide to Pharmacology Ligand ID

2994

compound 5ab [PMID: 8246233] (English)