Chem
J-GLOBAL ID：202107015098100132   Nikkaji number：J3.757.699I

Presaccharothriolide X

プレサッカロトリオリドX
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： C19H24O6
Molecular formula furigana： C19-H24-O6
Molecular weight： 348.395
InChI： InChI=1S/C19H24O6/c1-9-5-10(2)18(13-6-14(20)8-15(21)7-13)25-19(24)12(4)17(23)11(3)16(9)22/h5-8,10-12,17-18,20-21,23H,1-4H3/b9-5+/t10-,11-,12-,17-,18+/m1/s1
InChI key： RFQJAVYYIHIQAI-JXCSVPNJSA-N
SMILES： O1C(=O)[C@@H]([C@@H]([C@@H](C(=O)/C(=C/[C@H]([C@H]1c1cc(cc(c1)O)O)C)/C)C)O)C
Systematic name  (3)：
  • (3R,4R,5S,7E,9R,10S)-3,5,7,9-テトラメチル-4-ヒドロキシ-10-(3,5-ジヒドロキシフェニル)-3,4,9,10-テトラヒドロ-2H-オキセシン-2,6(5H)-ジオン
  • (3R,4R,5S,7E,9R,10S)-10-(3,5-ジヒドロキシフェニル)-4-ヒドロキシ-3,5,7,9-テトラメチル-3,4,5,6,9,10-ヘキサヒドロ-2H-オキセシン-2,6-ジオン
  • (3R,4R,5S,7E,9R,10S)-10-(3,5-dihydroxyphenyl)-4-hydroxy-3,5,7,9-tetramethyl-3,4,5,6,9,10-hexahydro-2H-oxecine-2,6-dione
Other name (4)：
  • (3R,4R,5S,7E,9R,10S)-10-(3,5-ジヒドロキシフェニル)-4-ヒドロキシ-3,5,7,9-テトラメチル-4,5,9,10-テトラヒドロ-3H-オキセシン-2,6-ジオン
  • プレサッカロトリオリドX
  • (3R,4R,5S,7E,9R,10S)-10-(3,5-dihydroxyphenyl)-4-hydroxy-3,5,7,9-tetramethyl-4,5,9,10-tetrahydro-3H-oxecine-2,6-dione
  • Presaccharothriolide X
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