Chem
J-GLOBAL ID：200907083013567932   Nikkaji number：J459.275A

Sophoraflavanone D

ソホラフラバノンD
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： C25H28O7
Molecular formula furigana： C25-H28-O7
Molecular weight： 440.492
InChI： InChI=1S/C25H28O7/c1-13(2)5-4-6-14(3)7-8-16-17(27)11-22-24(25(16)31)20(30)12-21(32-22)23-18(28)9-15(26)10-19(23)29/h5,7,9-11,21,26-29,31H,4,6,8,12H2,1-3H3/b14-7+/t21-/m0/s1
InChI key： BUPCGIYSKREVMZ-MYHKYFONSA-N
SMILES： CC(=CCC/C(=C/Cc1c(O)cc2O[C@@H](CC(=O)c2c1O)c1c(O)cc(O)cc1O)/C)C
Systematic name  (3)：
  • (2S)-2,3-ジヒドロ-2α-(2,4,6-トリヒドロキシフェニル)-5,7-ジヒドロキシ-6-[(2E)-3,7-ジメチル-2,6-オクタジエニル]-4H-1-ベンゾピラン-4-オン
  • (2S)-6-[(2E)-3,7-ジメチルオクタ-2,6-ジエン-1-イル]-5,7-ジヒドロキシ-2-(2,4,6-トリヒドロキシフェニル)-3,4-ジヒドロ-2H-1-ベンゾピラン-4-オン
  • (2S)-6-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-5,7-dihydroxy-2-(2,4,6-trihydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-4-one
Other name (3)：
  • ソホラフラバノンD
  • Sophoraflavanone D
  • (2S)-2,3-Dihydro-2α-(2,4,6-trihydroxyphenyl)-5,7-dihydroxy-6-[(2E)-3,7-dimethyl-2,6-octadienyl]-4H-1-benzopyran-4-one
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