Chem
J-GLOBAL ID：200907046263066073   Nikkaji number：J748.000H

Fumaric acid 1-(1β,1′-bi[cyclohexan]-4α-yl)4-(4-methoxyphenyl) ester

フマル酸1-(1β,1′-ビ[シクロヘキサン]-4α-イル)4-(4-メトキシフェニル)
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： C23H30O5
Molecular formula furigana： C23-H30-O5
Molecular weight： 386.488
InChI： InChI=1S/C23H30O5/c1-26-19-11-13-21(14-12-19)28-23(25)16-15-22(24)27-20-9-7-18(8-10-20)17-5-3-2-4-6-17/h11-18,20H,2-10H2,1H3/b16-15+/t18-,20-
InChI key： HCXLTDWZIPIUNX-NYAQLBFESA-N
SMILES： COc1ccc(OC(=O)/C=C/C(=O)O[C@H]2CC[C@@H](CC2)C2CCCCC2)cc1
Systematic name  (3)：
  • フマル酸1-(1β,1′-ビ[シクロヘキサン]-4α-イル)4-(4-メトキシフェニル)
  • 4-メトキシフェニル (1r,4r)-[1,1'-ビ(シクロヘキサン)]-4-イル (2E)-ブタ-2-エンジオアート
  • 4-methoxyphenyl (1r,4r)-[1,1'-bi(cyclohexane)]-4-yl (2E)-but-2-enedioate
Other name (1)：
  • Fumaric acid 1-(1β,1′-bi[cyclohexan]-4α-yl)4-(4-methoxyphenyl) ester
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