Chem
J-GLOBAL ID：200907009649198877   Nikkaji number：J522.942A

BMS-180291

BMS-180291
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： C25H32N2O5
Molecular formula furigana： C25-H32-N2-O5
Molecular weight： 440.540
InChI： InChI=1S/C25H32N2O5/c1-2-3-6-13-26-24(30)19-15-31-25(27-19)23-18(20-10-11-21(23)32-20)14-17-8-5-4-7-16(17)9-12-22(28)29/h4-5,7-8,15,18,20-21,23H,2-3,6,9-14H2,1H3,(H,26,30)(H,28,29)
InChI key： BBPRUNPUJIUXSE-UHFFFAOYSA-N
SMILES： CCCCCNC(=O)c1coc(n1)C1C2CCC(O2)C1Cc1ccccc1CCC(=O)O
Systematic name  (3)：
  • 2-[3-[4-(ペンチルカルバモイル)オキサゾール-2-イル]-7-オキサビシクロ[2.2.1]ヘプタン-2-イルメチル]ベンゼンプロピオン酸
  • 3-[2-({3-[4-(ペンチルカルバモイル)-1,3-オキサゾール-2-イル]-7-オキサビシクロ[2.2.1]ヘプタン-2-イル}メチル)フェニル]プロパン酸
  • 3-[2-({3-[4-(pentylcarbamoyl)-1,3-oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-yl}methyl)phenyl]propanoic acid
Other name (2)：
  • BMS-180291
  • 2-[3-[4-(Pentylcarbamoyl)oxazol-2-yl]-7-oxabicyclo[2.2.1]heptan-2-ylmethyl]benzenepropionic acid
Thsaurus map：
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