Chem
J-GLOBAL ID：200907063170460849   Nikkaji number：J1.156.026A

ZK-158252

ZK-158252
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： C29H36O3
Molecular formula furigana： C29-H36-O3
Molecular weight： 432.604
InChI： InChI=1S/C29H36O3/c30-27(29(22-11-23-29)21-10-14-24-12-2-1-3-13-24)19-8-6-17-25-15-4-5-16-26(25)18-7-9-20-28(31)32/h1-3,6,8,12-13,17-19,25,27,30H,4-5,7,9,11,15-16,20-23H2,(H,31,32)/t25-,27?/m0/s1
InChI key： HILRZHRCCODTSA-PVCWFJFTSA-N
SMILES： OC(C=CC=C[C@@H]1CCCCC1=CCCCC(=O)O)C1(CC#Cc2ccccc2)CCC1
Systematic name  (3)：
  • 5-[2α-[5-[1-(3-フェニル-2-プロピニル)シクロブタン-1-イル]-5-ヒドロキシ-1,3-ペンタジエン-1-イル]シクロヘキサン-1-イリデン]ペンタン酸
  • 5-[(2S)-2-{5-ヒドロキシ-5-[1-(3-フェニルプロパ-2-イン-1-イル)シクロブチル]ペンタ-1,3-ジエン-1-イル}シクロヘキシリデン]ペンタン酸
  • 5-[(2S)-2-{5-hydroxy-5-[1-(3-phenylprop-2-yn-1-yl)cyclobutyl]penta-1,3-dien-1-yl}cyclohexylidene]pentanoic acid
Other name (2)：
  • 5-[2α-[5-[1-(3-Phenyl-2-propynyl)cyclobutane-1-yl]-5-hydroxy-1,3-pentadiene-1-yl]cyclohexane-1-ylidene]pentanoic acid
  • ZK-158252
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