Chem
J-GLOBAL ID：200907085476362003   Nikkaji number：J2.577.822G

5,5′-[1,3-Phenylenebis(methyleneoxy)]bis[(1S,6β)-1β-methyl-3-oxo-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-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： C28H28O10
Molecular formula furigana： C28-H28-O10
Molecular weight： 524.522
InChI： InChI=1S/C28H28O10/c1-27-11-17-23(27)19(9-21(29)37-27)35-13-15-4-3-5-16(8-15)14-36-20-10-22(30)38-28(2)12-18(24(20)28)26(32)34-7-6-33-25(17)31/h3-5,8-10,17-18,23-24H,6-7,11-14H2,1-2H3/t17-,18-,23-,24-,27-,28-/m0/s1
InChI key： FAGJKIWHJOYEPB-IQXRLPOBSA-N
SMILES： C[C@]12C[C@H]3[C@H]1C(=CC(=O)O2)OCc1cccc(COC2=CC(=O)O[C@@]4(C)C[C@@H]([C@@H]24)C(=O)OCCOC3=O)c1
Systematic name  (3)：
  • 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-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)-15,26-ジメチル-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)-15,26-dimethyl-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 (1)：
  • 5,5′-[1,3-Phenylenebis(methyleneoxy)]bis[(1S,6β)-1β-methyl-3-oxo-2-oxabicyclo[4.2.0]octa-4-ene-7β-carboxylic acid]ethylene ester
Thsaurus map：
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