Chem
J-GLOBAL ID：200907000259820936   Nikkaji number：J259.900G

4-[[4β-(Aminomethyl)cyclohexan-1α-yl]carbonyl]benzenepropanoic acid

4-[[4β-(アミノメチル)シクロヘキサン-1α-イル]カルボニル]ベンゼンプロパン酸
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： C17H23NO3
Molecular formula furigana： C17-H23-N-O3
Molecular weight： 289.375
InChI： InChI=1S/C17H23NO3/c18-11-13-3-8-15(9-4-13)17(21)14-6-1-12(2-7-14)5-10-16(19)20/h1-2,6-7,13,15H,3-5,8-11,18H2,(H,19,20)/t13-,15-
InChI key： NVBZUCIQNYPGCI-CTYIDZIISA-N
SMILES： NC[C@H]1CC[C@@H](CC1)C(=O)c1ccc(CCC(=O)O)cc1
Systematic name  (3)：
  • 4-[[4β-(アミノメチル)シクロヘキサン-1α-イル]カルボニル]ベンゼンプロパン酸
  • 3-{4-[(1r,4r)-4-(アミノメチル)シクロヘキサンカルボニル]フェニル}プロパン酸
  • 3-{4-[(1r,4r)-4-(aminomethyl)cyclohexanecarbonyl]phenyl}propanoic acid
Other name (1)：
  • 4-[[4β-(Aminomethyl)cyclohexan-1α-yl]carbonyl]benzenepropanoic acid
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