Chem
J-GLOBAL ID:200907017615868388   Nikkaji number:J1.669.386C

3-[[3-[[(2S)-2-Methyl-3,6,9-trioxadecane-1-yl]oxycarbonyl]phenyl]ethynyl]-5-[(trimethylsilyl)ethynyl]benzoic acid (2S)-2-methyl-3,6,9-trioxadecane-1-yl ester

(2S)-2-[2-(2-メトキシエトキシ)エトキシ]プロピル 3-(2-{3-[(4S)-4-メチル-2,5,8,11-テトラオキサドデカノイル]フェニル}エチニル)-5-[2-(トリメチルシリル)エチニル]ベンゾアート
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: C37H50O10Si
Molecular formula furigana: C37-H50-O10-SI
Molecular weight: 682.882
InChI: InChI=1S/C37H50O10Si/c1-29(44-20-18-42-16-14-40-3)27-46-36(38)34-10-8-9-31(24-34)11-12-32-23-33(13-22-48(5,6)7)26-35(25-32)37(39)47-28-30(2)45-21-19-43-17-15-41-4/h8-10,23-26,29-30H,14-21,27-28H2,1-7H3/t29-,30-/m0/s1
InChI key: WGZXEVUXHMQYAS-KYJUHHDHSA-N
SMILES: COCCOCCO[C@@H](C)COC(=O)c1cccc(c1)C#Cc1cc(cc(c1)C(=O)OC[C@H](C)OCCOCCOC)C#C[Si](C)(C)C
Systematic name  (3):
  • 3-[[3-[[(2S)-2-メチル-3,6,9-トリオキサデカン-1-イル]オキシカルボニル]フェニル]エチニル]-5-[(トリメチルシリル)エチニル]安息香酸(2S)-2-メチル-3,6,9-トリオキサデカン-1-イル
  • (2S)-2-[2-(2-メトキシエトキシ)エトキシ]プロピル 3-(2-{3-[(4S)-4-メチル-2,5,8,11-テトラオキサドデカノイル]フェニル}エチニル)-5-[2-(トリメチルシリル)エチニル]ベンゾアート
  • (2S)-2-[2-(2-methoxyethoxy)ethoxy]propyl 3-(2-{3-[(4S)-4-methyl-2,5,8,11-tetraoxadodecanoyl]phenyl}ethynyl)-5-[2-(trimethylsilyl)ethynyl]benzoate
Other name (1):
  • 3-[[3-[[(2S)-2-Methyl-3,6,9-trioxadecane-1-yl]oxycarbonyl]phenyl]ethynyl]-5-[(trimethylsilyl)ethynyl]benzoic acid (2S)-2-methyl-3,6,9-trioxadecane-1-yl ester
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