Chem
J-GLOBAL ID：202007007465291799   Nikkaji number：J3.750.759H

Isoagarotetrol

イソアガロテトロール
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： C17H18O6
Molecular formula furigana： C17-H18-O6
Molecular weight： 318.325
InChI： InChI=1S/C17H18O6/c18-11-8-10(7-6-9-4-2-1-3-5-9)23-17-12(11)13(19)14(20)15(21)16(17)22/h1-5,8,13-16,19-22H,6-7H2/t13-,14+,15-,16+/m0/s1
InChI key： CWMIROLCTHMEEO-XUWVNRHRSA-N
SMILES： [C@H]1([C@H]([C@@H]([C@H](c2c1oc(cc2=O)CCc1ccccc1)O)O)O)O
Systematic name  (3)：
  • (5S,6R,7S,8R)-5,6,7,8-テトラヒドロ-5,6,7,8-テトラヒドロキシ-2-フェネチル-4H-1-ベンゾピラン-4-オン
  • (5S,6R,7S,8R)-5,6,7,8-テトラヒドロキシ-2-(2-フェニルエチル)-5,6,7,8-テトラヒドロ-4H-クロメン-4-オン
  • (5S,6R,7S,8R)-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one
Other name (4)：
  • (5S,6R,7S,8R)-5,6,7,8-テトラヒドロキシ-2-(2-フェニルエチル)-5,6,7,8-テトラヒドロクロメン-4-オン
  • イソアガロテトロール
  • (5S,6R,7S,8R)-5,6,7,8-tetrahydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-4-one
  • Isoagarotetrol
Thsaurus map：
Thesaurus Map

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