Chem
J-GLOBAL ID：200907063988259570   Nikkaji number：J240.069C

Echinoisoflavanone

エキノイソフラバノン
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： C22H24O7
Molecular formula furigana： C22-H24-O7
Molecular weight： 400.427
InChI： InChI=1S/C22H24O7/c1-11(2)5-6-13-16(27-3)8-7-14(21(13)28-4)22-20(26)19(25)18-15(24)9-12(23)10-17(18)29-22/h5,7-10,20,22-24,26H,6H2,1-4H3/t20-,22+/m1/s1
InChI key： AVDPDBYVBNYGLK-IRLDBZIGSA-N
SMILES： COc1ccc([C@@H]2Oc3cc(O)cc(O)c3C(=O)[C@H]2O)c(OC)c1CC=C(C)C
Systematic name  (3)：
  • (2S,3S)-2′,4′-ジメトキシ-3′-(3-メチル-2-ブテニル)-3,5,7-トリヒドロキシフラバノン
  • (2S,3S)-2-[2,4-ジメトキシ-3-(3-メチルブタ-2-エン-1-イル)フェニル]-3,5,7-トリヒドロキシ-3,4-ジヒドロ-2H-1-ベンゾピラン-4-オン
  • (2S,3S)-2-[2,4-dimethoxy-3-(3-methylbut-2-en-1-yl)phenyl]-3,5,7-trihydroxy-3,4-dihydro-2H-1-benzopyran-4-one
Other name (3)：
  • エキノイソフラバノン
  • Echinoisoflavanone
  • (2S,3S)-2′,4′-Dimethoxy-3′-(3-methyl-2-butenyl)-3,5,7-trihydroxyflavanone
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