Chem
J-GLOBAL ID:200907036813839380   Nikkaji number:J1.516.305D

(2S)-2-[[(1R,2R)-1-Ethyl-2-(benzyloxy)-4-pentenyl]oxy]-6-(benzyloxy)-4-hexene-1-ol

(2S)-2-[[(1R,2R)-1-エチル-2-(ベンジルオキシ)-4-ペンテニル]オキシ]-6-(ベンジルオキシ)-4-ヘキセン-1-オール
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: C27H36O4
Molecular formula furigana: C27-H36-O4
Molecular weight: 424.581
InChI: InChI=1S/C27H36O4/c1-3-13-27(30-22-24-16-9-6-10-17-24)26(4-2)31-25(20-28)18-11-12-19-29-21-23-14-7-5-8-15-23/h3,5-12,14-17,25-28H,1,4,13,18-22H2,2H3/t25-,26+,27+/m0/s1
InChI key: BUQQVRXJULDHEI-OYUWMTPXSA-N
SMILES: CC[C@@H](O[C@H](CO)CC=CCOCc1ccccc1)[C@@H](CC=C)OCc1ccccc1
Systematic name  (3):
  • (2S)-2-[[(1R,2R)-1-エチル-2-(ベンジルオキシ)-4-ペンテニル]オキシ]-6-(ベンジルオキシ)-4-ヘキセン-1-オール
  • (2S)-6-(ベンジルオキシ)-2-{[(3R,4R)-4-(ベンジルオキシ)ヘプタ-6-エン-3-イル]オキシ}ヘキサ-4-エン-1-オール
  • (2S)-6-(benzyloxy)-2-{[(3R,4R)-4-(benzyloxy)hept-6-en-3-yl]oxy}hex-4-en-1-ol
Other name (1):
  • (2S)-2-[[(1R,2R)-1-Ethyl-2-(benzyloxy)-4-pentenyl]oxy]-6-(benzyloxy)-4-hexene-1-ol
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