(Q105012020)

English

[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-5-[(R)-methylsulfinyl]-N-sulfooxypentanimidothioate

chemical compound

In more languages

Statements

type of chemical entity

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[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 5-methylsulfinyl-N-sulfooxypentanimidothioate

1 reference

based on heuristic

inferred from SMILES

437.048408936 dalton

1 reference

based on heuristic

inferred from SMILES

stereoisomer of

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1Z)-5-[(S)-methylsulfinyl]-N-sulfooxypentanimidothioate

1 reference

based on heuristic

inferred from InChIKey

[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (1E)-5-[(S)-methylsulfinyl]-N-sulfooxypentanimidothioate

1 reference

based on heuristic

inferred from InChI

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₂H₂₃NO₁₀S₃

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canonical SMILES

O=S(=O)(O)ON=C(SC1OC(CO)C(O)C(O)C1O)CCCC[S+]([O-])C

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isomeric SMILES

C[S@@+]([O-])CCCC/C(=N/OS(=O)(=O)O)S[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O

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Brassica oleracea

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Seasonal variation in glucosinolate content in Brassica oleracea crops grown in northwestern Spain

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Variation of glucosinolates in vegetable crops of Brassica rapa

Pringlea antiscorbutica

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Glucosinolates in the subantarctic crucifer Kerguelen cabbage (Pringlea antiscorbutica).

Capsella bursa-pastoris

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Glucosinolate spectrum of some AlgerianCruciferae

Identifiers

InChI=1S/C12H23NO10S3/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)/b13-8-/t7-,9-,10+,11+,12+,25+/m0/s1

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GMMLNKINDDUDCF-BDVZXRAKSA-N

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1 reference

17 September 2022

based on heuristic

inferred from InChIKey

UniChem compound ID

1 reference

Sitelinks

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