Chem
J-GLOBAL ID：200907041101176850   Nikkaji number：J1.235.811C

4-(4-Methoxyphenyl)butyric acid (3R)-4β-[(2R,3R)-2-methyl-3-(3-methyl-2-butenyl)oxiranyl]-5α-methoxy-1-oxaspiro[2.5]octane-6α-yl ester

4-(4-メトキシフェニル)酪酸(3R)-4β-[(2R,3R)-2-メチル-3-(3-メチル-2-ブテニル)オキシラニル]-5α-メトキシ-1-オキサスピロ[2.5]オクタン-6α-イル
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： C27H38O6
Molecular formula furigana： C27-H38-O6
Molecular weight： 458.595
InChI： InChI=1S/C27H38O6/c1-18(2)9-14-22-26(3,33-22)25-24(30-5)21(15-16-27(25)17-31-27)32-23(28)8-6-7-19-10-12-20(29-4)13-11-19/h9-13,21-22,24-25H,6-8,14-17H2,1-5H3/t21-,22-,24-,25-,26+,27+/m1/s1
InChI key： QVPDOOUPVPVKSS-ZTTYKKJNSA-N
SMILES： CO[C@@H]1[C@@H](CC[C@]2(CO2)[C@H]1[C@@]1(C)O[C@@H]1CC=C(C)C)OC(=O)CCCc1ccc(OC)cc1
Systematic name  (3)：
  • 4-(4-メトキシフェニル)酪酸(3R)-4β-[(2R,3R)-2-メチル-3-(3-メチル-2-ブテニル)オキシラニル]-5α-メトキシ-1-オキサスピロ[2.5]オクタン-6α-イル
  • (3R,4S,5S,6R)-5-メトキシ-4-[(2R,3R)-2-メチル-3-(3-メチルブタ-2-エン-1-イル)オキシラン-2-イル]-1-オキサスピロ[2.5]オクタン-6-イル 4-(4-メトキシフェニル)ブタノアート
  • (3R,4S,5S,6R)-5-methoxy-4-[(2R,3R)-2-methyl-3-(3-methylbut-2-en-1-yl)oxiran-2-yl]-1-oxaspiro[2.5]octan-6-yl 4-(4-methoxyphenyl)butanoate
Other name (1)：
  • 4-(4-Methoxyphenyl)butyric acid (3R)-4β-[(2R,3R)-2-methyl-3-(3-methyl-2-butenyl)oxiranyl]-5α-methoxy-1-oxaspiro[2.5]octane-6α-yl ester
Thsaurus map：
Thesaurus Map

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