Chem
J-GLOBAL ID：200907064775908554   Nikkaji number：J1.683.988D

Glucoarabidopsithalianin

グルコアラビドプシタリアニン
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： C14H27NO10S3
Molecular formula furigana： C14-H27-N-O10-S3
Molecular weight： 465.550
InChI： InChI=1S/C14H27NO10S3/c1-27(20)7-5-3-2-4-6-10(15-25-28(21,22)23)26-14-13(19)12(18)11(17)9(8-16)24-14/h9,11-14,16-19H,2-8H2,1H3,(H,21,22,23)/t9-,11-,12+,13-,14+,27?/m1/s1
InChI key： OOGAQHVYHLPICD-DNDZILKHSA-N
SMILES： CS(=O)CCCCCCC(=NOS(=O)(=O)O)S[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (4)：
  • 1-S-[1-(スルホオキシイミノ)-7-(メチルスルフィニル)ヘプチル]-1-チオ-β-D-グルコピラノース
  • 7-(メチルスルフィニル)-N-(スルホオキシ)ヘプタンイミドチオ酸S-β-D-グルコピラノシル
  • {[(7-メタンスルフィニル-1-{[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]スルファニル}ヘプチリデン)アミノ]オキシ}スルホン酸
  • {[(7-methanesulfinyl-1-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]sulfanyl}heptylidene)amino]oxy}sulfonic acid
Other name (4)：
  • 1-S-[1-(Sulfooxyimino)-7-(methylsulfinyl)heptyl]-1-thio-β-D-glucopyranose
  • 7-(Methylsulfinyl)-N-(sulfooxy)heptanimidothioic acid S-β-D-glucopyranosyl ester
  • Glucoarabidopsithalianin
  • グルコアラビドプシタリアニン
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