Chem
J-GLOBAL ID:200907042278029160   Nikkaji number:J2.577.826J

(1S,6β)-1β,7-Dimethyl-3-oxo-5,7β-[oxymethylene(1,3-phenylene)methyleneoxy[(1α)-2-oxo-4,7-dimethyl-3-oxabicyclo[4.2.0]octa-4-ene-6α,7β-diyl]carbonyloxyethyleneoxycarbonyl]-2-oxabicyclo[4.2.0]octa-4-ene

(1S,6β)-1β,7-ジメチル-3-オキソ-5,7β-[オキシメチレン(1,3-フェニレン)メチレンオキシ[(1α)-2-オキソ-4,7-ジメチル-3-オキサビシクロ[4.2.0]オクタ-4-エン-6α,7β-ジイル]カルボニルオキシエチレンオキシカルボニル]-2-オキサビシクロ[4.2.0]オクタ-4-エン
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/c1-17-12-30-20(24(32)39-17)13-28(30,3)26(34)36-9-8-35-25(33)27(2)16-29(4)23(27)21(11-22(31)40-29)37-14-18-6-5-7-19(10-18)15-38-30/h5-7,10-12,20,23H,8-9,13-16H2,1-4H3/t20-,23+,27-,28+,29-,30-/m0/s1
InChI key: GRPBMWLKKOWMLG-VYRNLMIASA-N
SMILES: CC1=C[C@@]23OCc4cccc(COC5=CC(=O)O[C@@]6(C)C[C@@](C)([C@@H]56)C(=O)OCCOC(=O)[C@@]2(C)C[C@H]3C(=O)O1)c4
Systematic name  (3):
  • (1S,6β)-1β,7-ジメチル-3-オキソ-5,7β-[オキシメチレン(1,3-フェニレン)メチレンオキシ[(1α)-2-オキソ-4,7-ジメチル-3-オキサビシクロ[4.2.0]オクタ-4-エン-6α,7β-ジイル]カルボニルオキシエチレンオキシカルボニル]-2-オキサビシクロ[4.2.0]オクタ-4-エン
  • (11S,16R,18S,25S,27S,31R)-13,18,25,27-テトラメチル-2,10,14,20,23,28-ヘキサオキサヘキサシクロ[23.5.1.14,8.011,16.011,18.027,31]ドトリアコンタ-1(30),4(32),5,7,12-ペンタエン-15,19,24,29-テトラオン
  • (11S,16R,18S,25S,27S,31R)-13,18,25,27-tetramethyl-2,10,14,20,23,28-hexaoxahexacyclo[23.5.1.14,8.011,16.011,18.027,31]dotriaconta-1(30),4(32),5,7,12-pentaene-15,19,24,29-tetrone
Other name (1):
  • (1S,6β)-1β,7-Dimethyl-3-oxo-5,7β-[oxymethylene(1,3-phenylene)methyleneoxy[(1α)-2-oxo-4,7-dimethyl-3-oxabicyclo[4.2.0]octa-4-ene-6α,7β-diyl]carbonyloxyethyleneoxycarbonyl]-2-oxabicyclo[4.2.0]octa-4-ene
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