Chem
J-GLOBAL ID：200907013297898323   Nikkaji number：J1.356.484A

7-[(1R)-2β-[(3R)-3-Hydroxy-4-(3-chlorophenoxy)butyl]-3α,5α-dihydroxycyclopentane-1α-yl]heptanoic acid

7-[(1R)-2β-[(3R)-3-ヒドロキシ-4-(3-クロロフェノキシ)ブチル]-3α,5α-ジヒドロキシシクロペンタン-1α-イル]ヘプタン酸
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： C22H33ClO6
Molecular formula furigana： C22-H33-CL-O6
Molecular weight： 428.950
InChI： InChI=1S/C22H33ClO6/c23-15-6-5-7-17(12-15)29-14-16(24)10-11-19-18(20(25)13-21(19)26)8-3-1-2-4-9-22(27)28/h5-7,12,16,18-21,24-26H,1-4,8-11,13-14H2,(H,27,28)/t16-,18-,19-,20+,21-/m1/s1
InChI key： XECZBZWECQIBDA-LELZANKISA-N
SMILES： O[C@H](CC[C@H]1[C@H](O)C[C@H](O)[C@@H]1CCCCCCC(=O)O)COc1cccc(Cl)c1
Systematic name  (3)：
  • 7-[(1R)-2β-[(3R)-3-ヒドロキシ-4-(3-クロロフェノキシ)ブチル]-3α,5α-ジヒドロキシシクロペンタン-1α-イル]ヘプタン酸
  • 7-[(1R,2R,3R,5S)-2-[(3R)-4-(3-クロロフェノキシ)-3-ヒドロキシブチル]-3,5-ジヒドロキシシクロペンチル]ヘプタン酸
  • 7-[(1R,2R,3R,5S)-2-[(3R)-4-(3-chlorophenoxy)-3-hydroxybutyl]-3,5-dihydroxycyclopentyl]heptanoic acid
Other name (1)：
  • 7-[(1R)-2β-[(3R)-3-Hydroxy-4-(3-chlorophenoxy)butyl]-3α,5α-dihydroxycyclopentane-1α-yl]heptanoic acid
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