(Q104253328)

English

[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxyhex-5-enimidothioate

group of stereoisomers with the chemical formula C₁₂H₂₁NO₉S₂

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instance of

group of stereoisomers

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subclass of

chemical compound

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mass

387.065773252 dalton

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based on heuristic

inferred from SMILES

chemical formula

C₁₂H₂₁NO₉S₂

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canonical SMILES

O=S(=O)(O)ON=C(SC1OC(CO)C(O)C(O)C1O)CCCC=C

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isomeric SMILES

C=CCCC/C(=N\OS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1O

1 reference

1 reference

Fate of Singrin in Methanol/Ammonia/Water-Hexane Extraction of B. juncea Mustard Seed

Brassica rapa

3 references

stated in

Separation and identification of glucosinolates of vegetable turnip rape by LC/APCI-MS and comparison of their contents in ten cultivars of vegetable turnip rape (Brassica rapaL.)

stated in

Determination of glucosinolates in canola seeds using anion exchange membrane extraction combined with the high-pressure liquid chromatography detection

stated in

Dietary glucosinolates as blocking agents against carcinogenesis: glucosinolate breakdown products assessed by induction of quinone reductase activity in murine hepa1c1c7 cells.

rapeseed

1 reference

stated in

Determination of glucosinolates in canola seeds using anion exchange membrane extraction combined with the high-pressure liquid chromatography detection

Identifiers

InChI

InChI=1S/C12H21NO9S2/c1-2-3-4-5-8(13-22-24(18,19)20)23-12-11(17)10(16)9(15)7(6-14)21-12/h2,7,9-12,14-17H,1,3-6H2,(H,18,19,20)/b13-8+

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InChIKey

XMJFVIGTHMOGNZ-MDWZMJQESA-N

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1 reference

26 December 2021

1 reference

(Q104253328)

[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-N-sulfooxyhex-5-enimidothioate

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Identifiers

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