Chem
J-GLOBAL ID：200907065370281089   Nikkaji number：J2.025.248K

(Z)-Neomanoalide 24,25-diacetate

(Z)-ネオマノアリド24,25-ジアセタート
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： C29H42O6
Molecular formula furigana： C29-H42-O6
Molecular weight： 486.649
InChI： InChI=1S/C29H42O6/c1-20(12-14-26-21(2)10-8-16-29(26,5)6)9-7-11-24(18-33-22(3)30)13-15-27-25(17-28(32)35-27)19-34-23(4)31/h9,13,17,27H,7-8,10-12,14-16,18-19H2,1-6H3/b20-9+,24-13-/t27-/m1/s1
InChI key： HUOUTXIIOOBRPE-VWPGDHEVSA-N
SMILES： CC(=O)OC/C(=C\C[C@H]1OC(=O)C=C1COC(=O)C)/CC/C=C(\C)/CCC1=C(C)CCCC1(C)C
Systematic name  (4)：
  • (R)-4-(アセトキシメチル)-5-[(2Z,6E)-3-(アセトキシメチル)-7-メチル-9-(2,6,6-トリメチル-1-シクロヘキセン-1-イル)-2,6-ノナジエニル]-2(5H)-フラノン
  • (5R)-4-(アセトキシメチル)-5-[(2Z,6E)-9-(2,6,6-トリメチル-1-シクロヘキセニル)-3-(アセトキシメチル)-7-メチル-2,6-ノナジエニル]-2(5H)-フラノン
  • (2Z,5E)-2-{2-[(2R)-3-[(アセチルオキシ)メチル]-5-オキソ-2,5-ジヒドロフラン-2-イル]エチリデン}-6-メチル-8-(2,6,6-トリメチルシクロヘキサ-1-エン-1-イル)オクタ-5-エン-1-イル アセタート
  • (2Z,5E)-2-{2-[(2R)-3-[(acetyloxy)methyl]-5-oxo-2,5-dihydrofuran-2-yl]ethylidene}-6-methyl-8-(2,6,6-trimethylcyclohex-1-en-1-yl)oct-5-en-1-yl acetate
Other name (6)：
  • (R)-4-(Acetoxymethyl)-5-[(2Z,6E)-3-(acetoxymethyl)-7-methyl-9-(2,6,6-trimethyl-1-cyclohexene-1-yl)-2,6-nonadienyl]-2(5H)-furanone
  • (6Z)-ネオマノアリド-23,24-ジアセタート
  • (6Z)-Neomanoalide-23,24-diacetate
  • (5R)-4-(Acetoxymethyl)-5-[(2Z,6E)-9-(2,6,6-trimethyl-1-cyclohexenyl)-3-(acetoxymethyl)-7-methyl-2,6-nonadienyl]-2(5H)-furanone
  • (Z)-ネオマノアリド24,25-ジアセタート
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