Chem
J-GLOBAL ID：200907027559269315   Nikkaji number：J385.665H

1-[N-(Potassiooxysulfonyloxy)imino]-5-methylsulfinylpentyl 1-thio-β-D-glucopyranoside

N-[(ポタシオスルホ)オキシ]-5-(メチルスルフィニル)ペンタンイミドチオ酸β-D-グルコピラノシル
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： C12H22KNO10S3
Molecular formula furigana： C12-H22-K-N-O10-S3
Molecular weight： 475.580
InChI： InChI=1S/C12H23NO10S3.K/c1-25(18)5-3-2-4-8(13-23-26(19,20)21)24-12-11(17)10(16)9(15)7(6-14)22-12;/h7,9-12,14-17H,2-6H2,1H3,(H,19,20,21);/q;+1/p-1/t7-,9-,10+,11-,12+,25?;/m1./s1
InChI key： XLJHNVPISVILLA-IXEHIFDJSA-M
SMILES： CS(=O)CCCCC(=NOS(=O)(=O)O[K])S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (4)：
  • 1-[N-(ポタシオオキシスルホニルオキシ)イミノ]-5-メチルスルフィニルペンチル1-チオ-β-D-グルコピラノシド
  • N-[(ポタシオスルホ)オキシ]-5-(メチルスルフィニル)ペンタンイミドチオ酸β-D-グルコピラノシル
  • (2R,3S,4S,5R,6S)-2-(ヒドロキシメチル)-6-{[5-メタンスルフィニル-1-({[(ポタッシオオキシ)スルホニル]オキシ}イミノ)ペンチル]スルファニル}オキサン-3,4,5-トリオール
  • (2R,3S,4S,5R,6S)-2-(hydroxymethyl)-6-{[5-methanesulfinyl-1-({[(potassiooxy)sulfonyl]oxy}imino)pentyl]sulfanyl}oxane-3,4,5-triol
Other name (2)：
  • 1-[N-(Potassiooxysulfonyloxy)imino]-5-methylsulfinylpentyl 1-thio-β-D-glucopyranoside
  • N-[(Potassiosulfo)oxy]-5-(methylsulfinyl)pentanimidothioic acid β-D-glucopyranosyl ester
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