Chem
J-GLOBAL ID:200907085068424378
Nikkaji number:J317.922B
Glucocheirolin
グルコケイロリン
Download MOL file
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:
C11 H20 KNO11 S3
Molecular formula furigana:
C11-H20-K-N-O11-S3
Molecular weight:
477.560
InChI:
InChI=1S/C11H21NO11S3.K/c1-25(17,18)4-2-3-7(12-23-26(19,20)21)24-11-10(16)9(15)8(14)6(5-13)22-11;/h6,8-11,13-16H,2-5H2,1H3,(H,19,20,21);/q;+1/p-1/t6-,8-,9+,10-,11+;/m1./s1
InChI key:
VANCNMMZVVUJJN-VLHAZNHLSA-M
SMILES:
CS(=O)(=O)CCCC(=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-チオ-β-D-グルコピラノース1-[4-(メチルスルホニル)-N-(ポタシオオキシスルホニルオキシ)ブタンイミダート]
1-チオ-β-D-グルコピラノース1-[N-[(ポタシオスルホ)オキシ]-4-(メチルスルホニル)ブタンイミダート]
(2R,3S,4S,5R,6S)-2-(ヒドロキシメチル)-6-{[4-メタンスルホニル-1-({[(ポタッシオオキシ)スルホニル]オキシ}イミノ)ブチル]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-{[4-methanesulfonyl-1-({[(potassiooxy)sulfonyl]oxy}imino)butyl]sulfanyl}oxane-3,4,5-triol
Other name (3):
1-Thio-β-D-glucopyranose 1-[N-[(potassiosulfo)oxy]-4-(methylsulfonyl)butanimidate]
グルコケイロリン
Glucocheirolin
CAS registry number:
15592-36-6
Regulation number (1):
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