Chem
J-GLOBAL ID：200907084058023891   Nikkaji number：J874.916G

(3S)-3β-[(4′-Heptyl-1,1′-biphenyl-4-yl)methyl]-5β-hexyldihydro-2(3H)-furanone

(3S,5R)-3-({4'-ヘプチル-[1,1'-ビフェニル]-4-イル}メチル)-5-ヘキシルオキソラン-2-オン
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： C30H42O2
Molecular formula furigana： C30-H42-O2
Molecular weight： 434.664
InChI： InChI=1S/C30H42O2/c1-3-5-7-9-10-12-24-14-18-26(19-15-24)27-20-16-25(17-21-27)22-28-23-29(32-30(28)31)13-11-8-6-4-2/h14-21,28-29H,3-13,22-23H2,1-2H3/t28-,29+/m0/s1
InChI key： BMSKGTMBABRETH-URLMMPGGSA-N
SMILES： CCCCCCCc1ccc(cc1)c1ccc(C[C@H]2C[C@@H](CCCCCC)OC2=O)cc1
Systematic name  (3)：
  • (3S)-3β-[(4′-ヘプチル-1,1′-ビフェニル-4-イル)メチル]-5β-ヘキシルジヒドロ-2(3H)-フラノン
  • (3S,5R)-3-({4'-ヘプチル-[1,1'-ビフェニル]-4-イル}メチル)-5-ヘキシルオキソラン-2-オン
  • (3S,5R)-3-({4'-heptyl-[1,1'-biphenyl]-4-yl}methyl)-5-hexyloxolan-2-one
Other name (1)：
  • (3S)-3β-[(4′-Heptyl-1,1′-biphenyl-4-yl)methyl]-5β-hexyldihydro-2(3H)-furanone
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