Chem
J-GLOBAL ID：201007058366387802   Nikkaji number：J2.804.635I

(2R)-2α-(4-Methylbenzoyloxymethyl)-3β-(4-methylbenzoyloxy)-5α-(2-pyridinylethynyl)tetrahydrofuran

(2R)-2α-(4-メチルベンゾイルオキシメチル)-3β-(4-メチルベンゾイルオキシ)-5α-(2-ピリジニルエチニル)テトラヒドロフラン
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： C28H25NO5
Molecular formula furigana： C28-H25-N-O5
Molecular weight： 455.510
InChI： InChI=1S/C28H25NO5/c1-19-6-10-21(11-7-19)27(30)32-18-26-25(34-28(31)22-12-8-20(2)9-13-22)17-24(33-26)15-14-23-5-3-4-16-29-23/h3-13,16,24-26H,17-18H2,1-2H3/t24-,25-,26+/m0/s1
InChI key： FAOBOXPIYOMHRT-KKUQBAQOSA-N
SMILES： Cc1ccc(cc1)C(=O)OC[C@H]1O[C@H](C[C@@H]1OC(=O)c1ccc(C)cc1)C#Cc1ccccn1
Systematic name  (3)：
  • (2R)-2α-(4-メチルベンゾイルオキシメチル)-3β-(4-メチルベンゾイルオキシ)-5α-(2-ピリジニルエチニル)テトラヒドロフラン
  • [(2R,3S,5R)-3-(4-メチルベンゾイルオキシ)-5-[2-(ピリジン-2-イル)エチニル]オキソラン-2-イル]メチル 4-メチルベンゾアート
  • [(2R,3S,5R)-3-(4-methylbenzoyloxy)-5-[2-(pyridin-2-yl)ethynyl]oxolan-2-yl]methyl 4-methylbenzoate
Other name (1)：
  • (2R)-2α-(4-Methylbenzoyloxymethyl)-3β-(4-methylbenzoyloxy)-5α-(2-pyridinylethynyl)tetrahydrofuran
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