Chem
J-GLOBAL ID：200907057304152666   Nikkaji number：J511.511F

Macrocarpal D

マクロカルパールD
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： C28H40O6
Molecular formula furigana： C28-H40-O6
Molecular weight： 472.622
InChI： InChI=1S/C28H40O6/c1-15(2)11-22(23-25(32)19(13-29)24(31)20(14-30)26(23)33)28(6)10-9-17-18(12-28)16(3)7-8-21(17)27(4,5)34/h12-17,21-22,31-34H,7-11H2,1-6H3
InChI key： UWQLZFWTBNFUDL-UHFFFAOYSA-N
SMILES： CC(C)CC(c1c(O)c(C=O)c(O)c(C=O)c1O)C1(C)CCC2C(CCC(C)C2=C1)C(C)(C)O
Systematic name  (4)：
  • 5-[1-[[2,3,4,4a,5,6,7,8-オクタヒドロ-2,8-ジメチル-5-(1-ヒドロキシ-1-メチルエチル)ナフタレン]-2-イル]-3-メチルブチル]-2,4,6-トリヒドロキシベンゼン-1,3-ジカルボアルデヒド
  • 2,4,6-トリヒドロキシ-5-[1-[[2,3,4,4a,5,6,7,8-オクタヒドロ-2,8-ジメチル-5-(1-ヒドロキシ-1-メチルエチル)ナフタレン]-2-イル]-3-メチルブチル]イソフタルアルデヒド
  • 2,4,6-トリヒドロキシ-5-{1-[5-(2-ヒドロキシプロパン-2-イル)-2,8-ジメチル-2,3,4,4a,5,6,7,8-オクタヒドロナフタレン-2-イル]-3-メチルブチル}ベンゼン-1,3-ジカルバルデヒド
  • 2,4,6-trihydroxy-5-{1-[5-(2-hydroxypropan-2-yl)-2,8-dimethyl-2,3,4,4a,5,6,7,8-octahydronaphthalen-2-yl]-3-methylbutyl}benzene-1,3-dicarbaldehyde
Other name (4)：
  • マクロカルパールD
  • Macrocarpal D
  • 2,4,6-Trihydroxy-5-[1-[[2,3,4,4a,5,6,7,8-octahydro-2,8-dimethyl-5-(1-hydroxy-1-methylethyl)naphthalen]-2-yl]-3-methylbutyl]isophthalaldehyde
  • 5-[1-[[2,3,4,4a,5,6,7,8-Octahydro-2,8-dimethyl-5-(1-hydroxy-1-methylethyl)naphthalen]-2-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde
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