Chem
J-GLOBAL ID：200907055851852106   Nikkaji number：J785.821C

Kompasinol A

コンパシノール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： C25H24O8
Molecular formula furigana： C25-H24-O8
Molecular weight： 452.459
InChI： InChI=1S/C25H24O8/c1-31-19-6-12(7-20(32-2)24(19)30)21-15-10-33-25(11-3-4-16(27)17(28)5-11)22(15)14-8-13(26)9-18(29)23(14)21/h3-9,15,21-22,25-30H,10H2,1-2H3/t15-,21-,22+,25-/m0/s1
InChI key： WVOKVBOSAJHZDQ-VHQADYEJSA-N
SMILES： COc1cc(cc(OC)c1O)[C@H]1[C@@H]2CO[C@H]([C@@H]2c2cc(O)cc(O)c12)c1ccc(O)c(O)c1
Systematic name  (3)：
  • 3β-(3,4-ジヒドロキシフェニル)-8β-(3,5-ジメトキシ-4-ヒドロキシフェニル)-3,3aβ,8,8aβ-テトラヒドロ-1H-インデノ[1,2-c]フラン-5,7-ジオール
  • (3R,3aS,8R,8aS)-3-(3,4-ジヒドロキシフェニル)-8-(4-ヒドロキシ-3,5-ジメトキシフェニル)-1H,3H,3aH,8H,8aH-インデノ[1,2-c]フラン-5,7-ジオール
  • (3R,3aS,8R,8aS)-3-(3,4-dihydroxyphenyl)-8-(4-hydroxy-3,5-dimethoxyphenyl)-1H,3H,3aH,8H,8aH-indeno[1,2-c]furan-5,7-diol
Other name (3)：
  • コンパシノールA
  • Kompasinol A
  • 3β-(3,4-Dihydroxyphenyl)-8β-(3,5-dimethoxy-4-hydroxyphenyl)-3,3aβ,8,8aβ-tetrahydro-1H-indeno[1,2-c]furan-5,7-diol
Thsaurus map：
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