Chem
J-GLOBAL ID:200907039599738596   Nikkaji number:J2.497.826E

5,5′-[1,3-Phenylenebis(methyleneoxy)]bis[(1S,6β)-1β-methyl-3-oxo-7-methyl-2-oxabicyclo[4.2.0]octa-4-ene-7β-carboxylic acid]ethylene ester

5,5′-[1,3-フェニレンビス(メチレンオキシ)]ビス[(1S,6β)-1β-メチル-3-オキソ-7-メチル-2-オキサビシクロ[4.2.0]オクタ-4-エン-7β-カルボン酸]エチレン
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: C30H32O10
Molecular formula furigana: C30-H32-O10
Molecular weight: 552.576
InChI: InChI=1S/C30H32O10/c1-27-15-29(3)23(27)19(11-21(31)39-29)37-13-17-6-5-7-18(10-17)14-38-20-12-22(32)40-30(4)16-28(2,24(20)30)26(34)36-9-8-35-25(27)33/h5-7,10-12,23-24H,8-9,13-16H2,1-4H3/t23-,24-,27+,28+,29+,30+/m1/s1
InChI key: VMZCADUVSVYFKR-QYCYNUJFSA-N
SMILES: C[C@]12C[C@@]3(C)[C@H]1C(=CC(=O)O2)OCc1cccc(COC2=CC(=O)O[C@@]4(C)C[C@@](C)([C@@H]24)C(=O)OCCOC3=O)c1
Systematic name  (4):
  • 5,5′-(1,3-フェニレン)ビス(メチレンオキシ)ビス[(1S,6R)-1β,7-ジメチル-3-オキソ-2-オキサビシクロ[4.2.0]オクタ-4-エン-7β-カルボン酸]1,2-エタンジイル
  • 5,5′-[1,3-フェニレンビス(メチレンオキシ)]ビス[(1S,6β)-1β-メチル-3-オキソ-7-メチル-2-オキサビシクロ[4.2.0]オクタ-4-エン-7β-カルボン酸]エチレン
  • (15S,16R,17S,24S,26S,30R)-15,17,24,26-テトラメチル-2,10,14,19,22,27-ヘキサオキサヘキサシクロ[22.5.1.14,8.115,17.011,16.026,30]ドトリアコンタ-1(29),4,6,8(32),11-ペンタエン-13,18,23,28-テトラオン
  • (15S,16R,17S,24S,26S,30R)-15,17,24,26-tetramethyl-2,10,14,19,22,27-hexaoxahexacyclo[22.5.1.14,8.115,17.011,16.026,30]dotriaconta-1(29),4,6,8(32),11-pentaene-13,18,23,28-tetrone
Other name (2):
  • 5,5′-(1,3-Phenylene)bis(methyleneoxy)bis[(1S,6R)-1β,7-dimethyl-3-oxo-2-oxabicyclo[4.2.0]octa-4-ene-7β-carboxylic acid]1,2-ethanediyl ester
  • 5,5′-[1,3-Phenylenebis(methyleneoxy)]bis[(1S,6β)-1β-methyl-3-oxo-7-methyl-2-oxabicyclo[4.2.0]octa-4-ene-7β-carboxylic acid]ethylene ester
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