Chem
J-GLOBAL ID：200907036599171953   Nikkaji number：J360.320B

SDZ-63370

(3R,5S,6E)-3,5-ジヒドロキシ-7-[5-(4-フルオロフェニル)-3-イソプロピル-1-フェニル-1H-ピラゾール-4-イル]-6-ヘプテン酸ナトリウム
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C25H26FN2NaO4
Molecular formula furigana： C25-H26-F-N2-NA-O4
Molecular weight： 460.481
InChI： InChI=1S/C25H27FN2O4.Na/c1-16(2)24-22(13-12-20(29)14-21(30)15-23(31)32)25(17-8-10-18(26)11-9-17)28(27-24)19-6-4-3-5-7-19;/h3-13,16,20-21,29-30H,14-15H2,1-2H3,(H,31,32);/q;+1/p-1/b13-12+;/t20-,21-;/m1./s1
InChI key： ABNXPCBQPDGROH-VRHXWEEISA-M
SMILES： CC(C)c1nn(c(c1/C=C/[C@@H](O)C[C@@H](O)CC(=O)O[Na])c1ccc(F)cc1)c1ccccc1
Systematic name  (3)：
  • (3R,5S,6E)-3,5-ジヒドロキシ-7-[5-(4-フルオロフェニル)-3-イソプロピル-1-フェニル-1H-ピラゾール-4-イル]-6-ヘプテン酸ナトリウム
  • ナトリウム (3R,5S,6E)-7-[5-(4-フルオロフェニル)-1-フェニル-3-(プロパン-2-イル)-1H-ピラゾール-4-イル]-3,5-ジヒドロキシヘプタ-6-エノアート
  • sodium (3R,5S,6E)-7-[5-(4-fluorophenyl)-1-phenyl-3-(propan-2-yl)-1H-pyrazol-4-yl]-3,5-dihydroxyhept-6-enoate
Other name (2)：
  • SDZ-63370
  • (3R,5S,6E)-3,5-Dihydroxy-7-[5-(4-fluorophenyl)-3-isopropyl-1-phenyl-1H-pyrazol-4-yl]-6-heptenoic acid sodium salt
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