Chem
J-GLOBAL ID：200907005472435800   Nikkaji number：J1.205.857H

3-Methyl-5,6-dimethoxy-2-(3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctene-1-yl)-1,4-benzoquinone

3-メチル-5,6-ジメトキシ-2-(3,7,11,15,19,23,27,31-オクタメチル-2,6,10,14,18,22,26,30-ドトリアコンタオクタエン-1-イル)-1,4-ベンゾキノン
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： C49H74O4
Molecular formula furigana： C49-H74-O4
Molecular weight： 727.127
InChI： InChI=1S/C49H74O4/c1-36(2)20-13-21-37(3)22-14-23-38(4)24-15-25-39(5)26-16-27-40(6)28-17-29-41(7)30-18-31-42(8)32-19-33-43(9)34-35-45-44(10)46(50)48(52-11)49(53-12)47(45)51/h20,22,24,26,28,30,32,34H,13-19,21,23,25,27,29,31,33,35H2,1-12H3
InChI key： ICFIZJQGJAJRSU-UHFFFAOYSA-N
SMILES： COC1=C(OC)C(=O)C(=C(C)C1=O)CC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)CCC=C(C)C
Systematic name  (3)：
  • 3-メチル-5,6-ジメトキシ-2-(3,7,11,15,19,23,27,31-オクタメチル-2,6,10,14,18,22,26,30-ドトリアコンタオクタエン-1-イル)-1,4-ベンゾキノン
  • 2,3-ジメトキシ-5-メチル-6-(3,7,11,15,19,23,27,31-オクタメチルドトリアコンタ-2,6,10,14,18,22,26,30-オクタエン-1-イル)シクロヘキサ-2,5-ジエン-1,4-ジオン
  • 2,3-dimethoxy-5-methyl-6-(3,7,11,15,19,23,27,31-octamethyldotriaconta-2,6,10,14,18,22,26,30-octaen-1-yl)cyclohexa-2,5-diene-1,4-dione
Other name (1)：
  • 3-Methyl-5,6-dimethoxy-2-(3,7,11,15,19,23,27,31-octamethyl-2,6,10,14,18,22,26,30-dotriacontaoctene-1-yl)-1,4-benzoquinone
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