Chem
J-GLOBAL ID：200907015201680120   Nikkaji number：J1.083.650F

2-Ketospirilloxanthin

2-ケトスピリロキサンチン
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： C42H58O3
Molecular formula furigana： C42-H58-O3
Molecular weight： 610.923
InChI： InChI=1S/C42H58O3/c1-34(22-15-24-36(3)26-17-28-38(5)30-19-33-41(7,8)44-11)20-13-14-21-35(2)23-16-25-37(4)27-18-29-39(6)31-32-40(43)42(9,10)45-12/h13-32H,33H2,1-12H3/b14-13+,22-15+,23-16+,26-17+,27-18+,30-19+,32-31+,34-20+,35-21+,36-24+,37-25+,38-28+,39-29+
InChI key： AUIMFBMJZYMMRO-MRLRKSOKSA-N
SMILES： COC(C)(C)C/C=C/C(=C/C=C/C(=C/C=C/C(=C/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C=C(\C)/C=C/C(=O)C(C)(C)OC)/C)/C)/C
Systematic name  (3)：
  • (3E,3′E,5E,5′E)-3,3′,4,4′-テトラデヒドロ-1,1′,2,2′-テトラヒドロ-1,1′-ジメトキシ-2-オキソ-ψ,ψ-カロテン
  • (4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E)-2,31-ジメトキシ-2,6,10,14,19,23,27,31-オクタメチルドトリアコンタ-4,6,8,10,12,14,16,18,20,22,24,26,28-トリデカエン-3-オン
  • (4E,6E,8E,10E,12E,14E,16E,18E,20E,22E,24E,26E,28E)-2,31-dimethoxy-2,6,10,14,19,23,27,31-octamethyldotriaconta-4,6,8,10,12,14,16,18,20,22,24,26,28-tridecaen-3-one
Other name (3)：
  • (3E,3′E,5E,5′E)-3,3′,4,4′-Tetradehydro-1,1′,2,2′-tetrahydro-1,1′-dimethoxy-2-oxo-ψ,ψ-carotene
  • 2-ケトスピリロキサンチン
  • 2-Ketospirilloxanthin
KEGG COMPOUND： C15884
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