Chem
J-GLOBAL ID:200907010541310857   Nikkaji number:J2.618.482G

Aplysinoplide B

アプリシノプリドB
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: C25H38O4
Molecular formula furigana: C25-H38-O4
Molecular weight: 402.575
InChI: InChI=1S/C25H38O4/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/h8,11,16,24,26,28H,5-7,9-10,12-15,17H2,1-4H3/b18-8+,20-11+
InChI key: PUFPKZKPRNHOHN-WOWDVTSRSA-N
SMILES: C/C(=C\CC/C(=C\CCC1=CC(=O)OC1O)/CO)/CCC1=C(C)CCCC1(C)C
Systematic name  (3):
  • 4-[(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)-3,7-デカジエニル]-5-ヒドロキシフラン-2(5H)-オン
  • 5-ヒドロキシ-4-[(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-3-エン-1-イル]-2,5-ジヒドロフラン-2-オン
  • 5-hydroxy-4-[(3E)-5-hydroxy-4-[(3E)-4-methyl-6-(2,6,6-trimethylcyclohex-1-en-1-yl)hex-3-en-1-yl]pent-3-en-1-yl]-2,5-dihydrofuran-2-one
Other name (3):
  • 4-[(3E,7E)-4-(Hydroxymethyl)-8-methyl-10-(2,6,6-trimethyl-1-cyclohexenyl)-3,7-decadienyl]-5-hydroxyfuran-2(5H)-one
  • アプリシノプリドB
  • Aplysinoplide B
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