Chem
J-GLOBAL ID：201107067649880706   Nikkaji number：J2.965.706H

(1S,2R,3S,4R)-1-[3-Methoxy-4-(tosyloxy)phenyl]-2,3-dimethyl-4-(1,3-benzodioxole-5-yl)butane-1,4-diol

(1S,2R,3S,4R)-1-[3-メトキシ-4-(トシルオキシ)フェニル]-2,3-ジメチル-4-(1,3-ベンゾジオキソール-5-イル)ブタン-1,4-ジオール
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： C27H30O8S
Molecular formula furigana： C27-H30-O8-S
Molecular weight： 514.590
InChI： InChI=1S/C27H30O8S/c1-16-5-9-21(10-6-16)36(30,31)35-23-12-8-19(13-24(23)32-4)26(28)17(2)18(3)27(29)20-7-11-22-25(14-20)34-15-33-22/h5-14,17-18,26-29H,15H2,1-4H3/t17-,18+,26+,27-/m1/s1
InChI key： BEONSKJYRODKMZ-JDEMJVTFSA-N
SMILES： COc1cc(ccc1OS(=O)(=O)c1ccc(C)cc1)[C@@H](O)[C@H](C)[C@H](C)[C@@H](O)c1ccc2OCOc2c1
Systematic name  (3)：
  • (1S,2R,3S,4R)-1-[3-メトキシ-4-(トシルオキシ)フェニル]-2,3-ジメチル-4-(1,3-ベンゾジオキソール-5-イル)ブタン-1,4-ジオール
  • 4-[(1S,2R,3S,4R)-4-(2H-1,3-ベンゾジオキソール-5-イル)-1,4-ジヒドロキシ-2,3-ジメチルブチル]-2-メトキシフェニル 4-メチルベンゼン-1-スルホナート
  • 4-[(1S,2R,3S,4R)-4-(2H-1,3-benzodioxol-5-yl)-1,4-dihydroxy-2,3-dimethylbutyl]-2-methoxyphenyl 4-methylbenzene-1-sulfonate
Other name (1)：
  • (1S,2R,3S,4R)-1-[3-Methoxy-4-(tosyloxy)phenyl]-2,3-dimethyl-4-(1,3-benzodioxole-5-yl)butane-1,4-diol
Thsaurus map：
Thesaurus Map

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