Chem
J-GLOBAL ID：200907067416306300   Nikkaji number：J2.618.481I

Aplysinoplide A

アプリシノプリドA
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： C25H36O4
Molecular formula furigana： C25-H36-O4
Molecular weight： 400.559
InChI： InChI=1S/C25H36O4/c1-18(13-14-22-19(2)9-7-15-25(22,3)4)8-5-10-20(17-26)11-6-12-21-16-23(27)29-24(21)28/h6,8,11-12,16,24,26,28H,5,7,9-10,13-15,17H2,1-4H3/b12-6+,18-8+,20-11+
InChI key： IXZLFRIHNOJYGA-QGBXNASSSA-N
SMILES： C/C(=C\CC/C(=C\C=C\C1=CC(=O)OC1O)/CO)/CCC1=C(C)CCCC1(C)C
Systematic name  (3)：
  • 4-[(1E,3E,7E)-4-(ヒドロキシメチル)-8-メチル-10-(2,6,6-トリメチル-1-シクロヘキセニル)-1,3,7-デカトリエニル]-5-ヒドロキシフラン-2(5H)-オン
  • 5-ヒドロキシ-4-[(1E,3E)-5-ヒドロキシ-4-[(3E)-4-メチル-6-(2,6,6-トリメチルシクロヘキサ-1-エン-1-イル)ヘキサ-3-エン-1-イル]ペンタ-1,3-ジエン-1-イル]-2,5-ジヒドロフラン-2-オン
  • 5-hydroxy-4-[(1E,3E)-5-hydroxy-4-[(3E)-4-methyl-6-(2,6,6-trimethylcyclohex-1-en-1-yl)hex-3-en-1-yl]penta-1,3-dien-1-yl]-2,5-dihydrofuran-2-one
Other name (3)：
  • 4-[(1E,3E,7E)-4-(Hydroxymethyl)-8-methyl-10-(2,6,6-trimethyl-1-cyclohexenyl)-1,3,7-decatrienyl]-5-hydroxyfuran-2(5H)-one
  • アプリシノプリドA
  • Aplysinoplide A
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