Chem
J-GLOBAL ID：201507018098508559   Nikkaji number：J3.417.854B

Saccharothriolide B

サッカロトリオリドB
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： C25H31NO7
Molecular formula furigana： C25-H31-N-O7
Molecular weight： 457.523
InChI： InChI=1S/C25H31NO7/c1-12-21(26-19-7-5-6-8-20(19)29)13(2)24(16-9-17(27)11-18(28)10-16)33-25(32)15(4)23(31)14(3)22(12)30/h5-15,21,23-24,26-29,31H,1-4H3/t12-,13-,14?,15-,21+,23+,24?/m1/s1
InChI key： PUFJWNRDGMBDGV-FTVOKXEASA-N
SMILES： C[C@@H]1[C@@H](Nc2ccccc2O)[C@@H](C)C(=O)C(C)[C@H](O)[C@@H](C)C(=O)OC1c1cc(O)cc(O)c1
Systematic name  (3)：
  • (3R,4S,7R,8R,9R,10S)-3,5,7,9-テトラメチル-4-ヒドロキシ-8-(2-ヒドロキシアニリノ)-10-(3,5-ジヒドロキシフェニル)オキセカン-2,6-ジオン
  • (3R,4S,7R,8R,9R,10S)-10-(3,5-ジヒドロキシフェニル)-4-ヒドロキシ-8-[(2-ヒドロキシフェニル)アミノ]-3,5,7,9-テトラメチルオキセカン-2,6-ジオン
  • (3R,4S,7R,8R,9R,10S)-10-(3,5-dihydroxyphenyl)-4-hydroxy-8-[(2-hydroxyphenyl)amino]-3,5,7,9-tetramethyloxecane-2,6-dione
Other name (3)：
  • (3R,4S,7R,8R,9R,10S)-3,5,7,9-Tetramethyl-4-hydroxy-8-(2-hydroxyanilino)-10-(3,5-dihydroxyphenyl)oxecane-2,6-dione
  • サッカロトリオリドB
  • Saccharothriolide B
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