Chem
J-GLOBAL ID：200907040314288116   Nikkaji number：J2.250.658G

5-O-Methylhirsutanonol

5-O-メチルヒルスタノノール
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： C20H24O6
Molecular formula furigana： C20-H24-O6
Molecular weight： 360.406
InChI： InChI=1S/C20H24O6/c1-26-16(7-3-14-5-9-18(23)20(25)11-14)12-15(21)6-2-13-4-8-17(22)19(24)10-13/h4-5,8-11,16,22-25H,2-3,6-7,12H2,1H3/t16-/m0/s1
InChI key： KGQIYLSVVQCRJA-INIZCTEOSA-N
SMILES： CO[C@@H](CCc1ccc(O)c(O)c1)CC(=O)CCc1ccc(O)c(O)c1
Systematic name  (3)：
  • (S)-1,7-ビス(3,4-ジヒドロキシフェニル)-5-メトキシ-3-ヘプタノン
  • (5S)-1,7-ビス(3,4-ジヒドロキシフェニル)-5-メトキシヘプタン-3-オン
  • (5S)-1,7-bis(3,4-dihydroxyphenyl)-5-methoxyheptan-3-one
Other name (3)：
  • (S)-1,7-Bis(3,4-dihydroxyphenyl)-5-methoxy-3-heptanone
  • 5-O-メチルヒルスタノノール
  • 5-O-Methylhirsutanonol
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