Chem
J-GLOBAL ID：200907062660327555   Nikkaji number：J1.712.876K

Gneafricanin A

グネアフリカニンA
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： C29H24O8
Molecular formula furigana： C29-H24-O8
Molecular weight： 500.503
InChI： InChI=1S/C29H24O8/c1-36-25-9-15(4-7-22(25)33)2-3-16-8-24(35)28-26(10-16)37-29(21-6-5-18(30)14-23(21)34)27(28)17-11-19(31)13-20(32)12-17/h2-14,27,29-35H,1H3/t27-,29+/m0/s1
InChI key： FRSXGOALDPPUOO-LMSSTIIKSA-N
SMILES： COc1cc(C=Cc2cc3O[C@@H]([C@H](c3c(O)c2)c2cc(O)cc(O)c2)c2ccc(O)cc2O)ccc1O
Systematic name  (3)：
  • 2α-(2,4-ジヒドロキシフェニル)-3β-(3,5-ジヒドロキシフェニル)-6-(3-メトキシ-4-ヒドロキシスチリル)-2,3-ジヒドロベンゾフラン-4-オール
  • 5-[(2S,3S)-2-(2,4-ジヒドロキシフェニル)-4-ヒドロキシ-6-[2-(4-ヒドロキシ-3-メトキシフェニル)エテニル]-2,3-ジヒドロ-1-ベンゾフラン-3-イル]ベンゼン-1,3-ジオール
  • 5-[(2S,3S)-2-(2,4-dihydroxyphenyl)-4-hydroxy-6-[2-(4-hydroxy-3-methoxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]benzene-1,3-diol
Other name (3)：
  • 2α-(2,4-Dihydroxyphenyl)-3β-(3,5-dihydroxyphenyl)-6-(3-methoxy-4-hydroxystyryl)-2,3-dihydrobenzofuran-4-ol
  • グネアフリカニンA
  • Gneafricanin A
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