Chem
J-GLOBAL ID:200907062649828666   Nikkaji number:J93.211F

5-Demethoxyubiquinone 6

5-デメトキシユビキノン6
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: C38H56O3
Molecular formula furigana: C38-H56-O3
Molecular weight: 560.863
InChI: InChI=1S/C38H56O3/c1-28(2)15-10-16-29(3)17-11-18-30(4)19-12-20-31(5)21-13-22-32(6)23-14-24-33(7)25-26-35-34(8)36(39)27-37(41-9)38(35)40/h15,17,19,21,23,25,27H,10-14,16,18,20,22,24,26H2,1-9H3/b29-17+,30-19+,31-21+,32-23+,33-25+
InChI key: RLVSEUWSBSQQOE-NSUIJKAQSA-N
SMILES: COC1=CC(=O)C(=C(C/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)C1=O)C
Systematic name  (4):
  • 3-メトキシ-6-メチル-5-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-ヘキサメチル-2,6,10,14,18,22-テトラコサヘキサエニル]-2,5-シクロヘキサジエン-1,4-ジオン
  • 2-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-ヘキサメチル-2,6,10,14,18,22-テトラコサヘキサエニル]-3-メチル-6-メトキシ-1,4-ベンゾキノン
  • 3-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-ヘキサメチルテトラコサ-2,6,10,14,18,22-ヘキサエン-1-イル]-5-メトキシ-2-メチルシクロヘキサ-2,5-ジエン-1,4-ジオン
  • 3-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyltetracosa-2,6,10,14,18,22-hexaen-1-yl]-5-methoxy-2-methylcyclohexa-2,5-diene-1,4-dione
Other name (8):
  • 5-デスメトキシユビキノン6
  • 5-デメトキシユビキノン6
  • 5-Desmethoxyubiquinone 6
  • 5-Demethoxyubiquinone 6
  • 3-Methoxy-6-methyl-5-[(2E,6E,10E,14E,18E)-3,7,11,15,19,23-hexamethyl-2,6,10,14,18,22-tetracosahexenyl]-2,5-cyclohexadiene-1,4-dione
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KEGG COMPOUND: C05804
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