Chem
J-GLOBAL ID：200907064001227406   Nikkaji number：J2.618.483E

Aplysinoplide C

アプリシノプリドC
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： C25H40O5
Molecular formula furigana： C25-H40-O5
Molecular weight： 420.590
InChI： InChI=1S/C25H40O5/c1-18(9-12-22-24(2,3)13-6-14-25(22,4)29)7-5-8-19(16-26)10-11-21-20(17-27)15-23(28)30-21/h7,10,15,21-22,26-27,29H,5-6,8-9,11-14,16-17H2,1-4H3/b18-7+,19-10-
InChI key： BYAXMGMKQCMKDN-MXZVUSGPSA-N
SMILES： C/C(=C\CC/C(=C/CC1OC(=O)C=C1CO)/CO)/CCC1C(C)(C)CCCC1(C)O
Systematic name  (3)：
  • 4-(ヒドロキシメチル)-5-[(2Z,6E)-3-(ヒドロキシメチル)-7-メチル-9-(2-ヒドロキシ-2,6,6-トリメチルシクロヘキシル)-2,6-ノナジエニル]フラン-2(5H)-オン
  • 5-[(2Z)-4-ヒドロキシ-3-[(3E)-6-(2-ヒドロキシ-2,6,6-トリメチルシクロヘキシル)-4-メチルヘキサ-3-エン-1-イル]ブタ-2-エン-1-イル]-4-(ヒドロキシメチル)-2,5-ジヒドロフラン-2-オン
  • 5-[(2Z)-4-hydroxy-3-[(3E)-6-(2-hydroxy-2,6,6-trimethylcyclohexyl)-4-methylhex-3-en-1-yl]but-2-en-1-yl]-4-(hydroxymethyl)-2,5-dihydrofuran-2-one
Other name (3)：
  • 4-(Hydroxymethyl)-5-[(2Z,6E)-3-(hydroxymethyl)-7-methyl-9-(2-hydroxy-2,6,6-trimethylcyclohexyl)-2,6-nonadienyl]furan-2(5H)-one
  • アプリシノプリドC
  • Aplysinoplide C
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