Chem
J-GLOBAL ID：200907009698707191   Nikkaji number：J578.011J

(6E)-7-[2,3-Bis(4-fluorophenyl)-4-bromo-5-isopropyl-1H-pyrrol-1-yl]-3,5-dihydroxy-6-heptenoic acid methyl ester

(6E)-7-[2,3-ビス(4-フルオロフェニル)-4-ブロモ-5-イソプロピル-1H-ピロール-1-イル]-3,5-ジヒドロキシ-6-ヘプテン酸メチル
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： C27H28BrF2NO4
Molecular formula furigana： C27-H28-BR-F2-N-O4
Molecular weight： 548.425
InChI： InChI=1S/C27H28BrF2NO4/c1-16(2)26-25(28)24(17-4-8-19(29)9-5-17)27(18-6-10-20(30)11-7-18)31(26)13-12-21(32)14-22(33)15-23(34)35-3/h4-13,16,21-22,32-33H,14-15H2,1-3H3/b13-12+
InChI key： MUTCAPXLKRYEPR-OUKQBFOZSA-N
SMILES： COC(=O)CC(O)CC(O)/C=C/n1c(C(C)C)c(Br)c(c1c1ccc(F)cc1)c1ccc(F)cc1
Systematic name  (3)：
  • (6E)-7-[2,3-ビス(4-フルオロフェニル)-4-ブロモ-5-イソプロピル-1H-ピロール-1-イル]-3,5-ジヒドロキシ-6-ヘプテン酸メチル
  • メチル (6E)-7-[3-ブロモ-4,5-ビス(4-フルオロフェニル)-2-(プロパン-2-イル)-1H-ピロール-1-イル]-3,5-ジヒドロキシヘプタ-6-エノアート
  • methyl (6E)-7-[3-bromo-4,5-bis(4-fluorophenyl)-2-(propan-2-yl)-1H-pyrrol-1-yl]-3,5-dihydroxyhept-6-enoate
Other name (1)：
  • (6E)-7-[2,3-Bis(4-fluorophenyl)-4-bromo-5-isopropyl-1H-pyrrol-1-yl]-3,5-dihydroxy-6-heptenoic acid methyl ester
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