Chem
J-GLOBAL ID：200907023416439729   Nikkaji number：J629.588F

3′,4′-Di-O-(S)-camphanoyl-(+)-cis-khellactone

3′,4′-ジ-(O)-(-)-カンファノイル-(+)-ケルラクトン
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： C34H38O11
Molecular formula furigana： C34-H38-O11
Molecular weight： 622.667
InChI： InChI=1S/C34H38O11/c1-28(2)23(42-27(39)34-16-14-32(8,25(37)45-34)30(34,5)6)22(20-18(43-28)11-9-17-10-12-19(35)40-21(17)20)41-26(38)33-15-13-31(7,24(36)44-33)29(33,3)4/h9-12,22-23H,13-16H2,1-8H3/t22-,23-,31+,32+,33-,34-/m1/s1
InChI key： ZJIDTNTWJHYPGM-HRWZLDHOSA-N
SMILES： CC1(C)[C@@]2(C)CC[C@@]1(OC2=O)C(=O)O[C@H]1[C@@H](OC(=O)[C@@]23CC[C@@](C)(C(=O)O2)C3(C)C)C(C)(C)Oc2ccc3ccc(=O)oc3c12
Systematic name  (8)：
  • ビス[(1S,4R)-3-オキソ-4,7,7-トリメチル-2-オキサビシクロ[2.2.1]ヘプタン-1-カルボン酸][(9R,10R)-2-オキソ-8,8-ジメチル-9,10-ジヒドロ-2H,8H-ベンゾ[1,2-b:3,4-b′]ジピラン]-9,10-ジイル
  • ビス[(1S,4R)-4,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1-カルボン酸][(9R)-2-オキソ-8,8-ジメチル-9,10-ジヒドロ-2H,8H-ベンゾ[1,2-b:3,4-b′]ジピラン]-9α,10α-ジイル
  • (9R)-8,8-ジメチル-9α,10α-ビス[[(1S,4R)-4,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1-イル]カルボニルオキシ]-9,10-ジヒドロ-2H,8H-ベンゾ[1,2-b:3,4-b′]ジピラン-2-オン
  • (9R,10R)-8,8-ジメチル-9,10-ビス[[(1S,4R)-4,7,7-トリメチル-3-オキシ-2-オキサビシクロ[2.2.1]ヘプタン-1-イル]カルボニルオキシ]-9,10-ジヒドロ-2H,8H-ベンゾ[1,2-b:3,4-b′]ジピラン-2-オン
  • (9R)-9,10-ジヒドロ-8,8-ジメチル-9α,10α-ビス[(4α,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1α-イル)カルボニルオキシ]-2H,8H-ベンゾ[1,2-b:3,4-b′]ジピラン-2-オン
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Other name (9)：
  • Bis[(1S,4R)-3-oxo-4,7,7-trimethyl-2-oxabicyclo[2.2.1]heptane-1-carboxylic acid][(9R,10R)-2-oxo-8,8-dimethyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b′]dipyran]-9,10-diyl ester
  • Bis[(1S,4R)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylic acid][(9R)-2-oxo-8,8-dimethyl-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b′]dipyran]-9α,10α-diyl ester
  • (9R)-8,8-Dimethyl-9α,10α-bis[[(1S,4R)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-yl]carbonyloxy]-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b′]dipyran-2-one
  • (9R,10R)-8,8-Dimethyl-9,10-bis[[(1S,4R)-4,7,7-trimethyl-3-oxy-2-oxabicyclo[2.2.1]heptane-1-yl]carbonyloxy]-9,10-dihydro-2H,8H-benzo[1,2-b:3,4-b′]dipyran-2-one
  • 3′,4′-ジ-O-(S)-カンファノイル-(+)-cis-ケールラクトン
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