Chem
J-GLOBAL ID：200907033385091880   Nikkaji number：J1.945.009K

Gancaonin D

ガンカオニン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： C21H20O7
Molecular formula furigana： C21-H20-O7
Molecular weight： 384.384
InChI： InChI=1S/C21H20O7/c1-11(9-22)3-5-13-15(23)8-17(25)19-20(26)14(10-28-21(13)19)12-4-6-18(27-2)16(24)7-12/h3-4,6-8,10,22-25H,5,9H2,1-2H3/b11-3+
InChI key： UCKSAYIMWMIZQJ-QDEBKDIKSA-N
SMILES： COc1ccc(cc1O)c1coc2c(C/C=C(\C)/CO)c(O)cc(O)c2c1=O
Systematic name  (3)：
  • 3′,5,7-トリヒドロキシ-4′-メトキシ-8-[(E)-3-(ヒドロキシメチル)-2-ブテニル]イソフラボン
  • 5,7-ジヒドロキシ-8-[(2E)-4-ヒドロキシ-3-メチルブタ-2-エン-1-イル]-3-(3-ヒドロキシ-4-メトキシフェニル)-4H-クロメン-4-オン
  • 5,7-dihydroxy-8-[(2E)-4-hydroxy-3-methylbut-2-en-1-yl]-3-(3-hydroxy-4-methoxyphenyl)-4H-chromen-4-one
Other name (3)：
  • 3′,5,7-Trihydroxy-4′-methoxy-8-[(E)-3-(hydroxymethyl)-2-butenyl]isoflavone
  • ガンカオニンD
  • Gancaonin D
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