Chem
J-GLOBAL ID：200907021645614418   Nikkaji number：J2.054.638G

9-Deoxy-9β-chloro-PGE2

9-デオキシ-9β-クロロ-PGE2
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： C20H33ClO4
Molecular formula furigana： C20-H33-CL-O4
Molecular weight： 372.930
InChI： InChI=1S/C20H33ClO4/c1-2-3-6-9-15(22)12-13-17-16(18(21)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,22-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16+,17+,18+,19+/m0/s1
InChI key： RDZUDQFNGNUIKH-JZFBHDEDSA-N
SMILES： CCCCC[C@H](O)/C=C/[C@H]1[C@H](O)C[C@@H](Cl)[C@@H]1C/C=C\CCCC(=O)O
Systematic name  (4)：
  • (5Z,8R,13E,15S)-11α,15-ジヒドロキシ-9β-クロロプロスタ-5,13-ジエン-1-酸
  • (5Z,8R,11R,12R,13E,15S)-9β-クロロ-11,15-ジヒドロキシプロスタ-5,13-ジエン-1-酸
  • (5Z)-7-[(1R,2R,3R,5R)-5-クロロ-3-ヒドロキシ-2-[(1E,3S)-3-ヒドロキシオクタ-1-エン-1-イル]シクロペンチル]ヘプタ-5-エン酸
  • (5Z)-7-[(1R,2R,3R,5R)-5-chloro-3-hydroxy-2-[(1E,3S)-3-hydroxyoct-1-en-1-yl]cyclopentyl]hept-5-enoic acid
Other name (4)：
  • (5Z,8R,13E,15S)-11α,15-Dihydroxy-9β-chloroprosta-5,13-diene-1-oic acid
  • 9-デオキシ-9β-クロロ-PGE2
  • 9-Deoxy-9β-chloro-PGE2
  • (5Z,8R,11R,12R,13E,15S)-9β-Chloro-11,15-dihydroxyprosta-5,13-diene-1-oic acid
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