Chem
J-GLOBAL ID：202007015582647246   Nikkaji number：J3.750.764D

(5S,6S,7S,8S)-8-chloro-5,6,7-trihydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-4-one

(5S,6S,7S,8S)-8-クロロ-5,6,7-トリヒドロキシ-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
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： C17H17ClO5
Molecular formula furigana： C17-H17-CL-O5
Molecular weight： 336.770
InChI： InChI=1S/C17H17ClO5/c18-13-15(21)16(22)14(20)12-11(19)8-10(23-17(12)13)7-6-9-4-2-1-3-5-9/h1-5,8,13-16,20-22H,6-7H2/t13-,14-,15+,16-/m0/s1
InChI key： WCUYELNCMCEJQL-JONQDZQNSA-N
SMILES： [C@@H]1([C@H]([C@H]([C@H](c2c1oc(cc2=O)CCc1ccccc1)O)O)O)Cl
Systematic name  (3)：
  • (5S,6S,7S,8S)-8-クロロ-5,6,7,8-テトラヒドロ-5,6,7-トリヒドロキシ-2-フェネチル-4H-1-ベンゾピラン-4-オン
  • (5S,6S,7S,8S)-8-クロロ-5,6,7-トリヒドロキシ-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,6S,7S,8S)-8-chloro-5,6,7-trihydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydro-4H-chromen-4-one
Other name (2)：
  • (5S,6S,7S,8S)-8-クロロ-5,6,7-トリヒドロキシ-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
  • (5S,6S,7S,8S)-8-chloro-5,6,7-trihydroxy-2-(2-phenylethyl)-5,6,7,8-tetrahydrochromen-4-one
Thsaurus map：
Thesaurus Map

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