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

group of stereoisomers with the chemical formula C₁₅H₂₁NO₉S₂
ChemicalSubstance group_of_stereoisomers Q104962380
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[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate

Summary

[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate is a group of stereoisomers[1].

Key Facts

  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's instance of is recorded as group of stereoisomers[2].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's canonical SMILES is recorded as O=S(=O)(O)ON=C(SC1OC(CO)C(O)C(O)C1O)CCC=2C=CC=CC2[3].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's InChI is recorded as InChI=1S/C15H21NO9S2/c17-8-10-12(18)13(19)14(20)15(24-10)26-11(16-25-27(21,22)23)7-6-9-4-2-1-3-5-9/h1-5,10,12-15,17-20H,6-8H2,(H,21,22,23)[4].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's InChIKey is recorded as CKIJIGYDFNXSET-UHFFFAOYSA-N[5].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's chemical formula is recorded as C₁₅H₂₁NO₉S₂[6].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's subclass of is recorded as chemical compound[7].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's PubChem CID is recorded as 4379664[8].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as Brassica juncea[9].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as Brassica nigra[10].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as Brassica rapa[11].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as Reseda stricta[12].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as Reseda alba[13].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as Reseda luteola[14].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as Brassica oleracea[15].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as broccoli[16].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's found in taxon is recorded as Sinapis alba[17].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's mass is recorded as {'unit': 'http://www.wikidata.org/entity/Q483261', 'amount': '+423.065773252'}[18].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's MassBank accession ID is recorded as MSBNK-RIKEN_ReSpect-PS107907[19].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's MassBank accession ID is recorded as MSBNK-RIKEN_ReSpect-PS107908[20].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's MassBank accession ID is recorded as MSBNK-RIKEN_ReSpect-PS107909[21].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's MassBank accession ID is recorded as MSBNK-RIKEN_ReSpect-PS107910[22].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's MassBank accession ID is recorded as MSBNK-RIKEN_ReSpect-PS107911[23].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's MassBank accession ID is recorded as MSBNK-RIKEN_ReSpect-PS107912[24].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's MassBank accession ID is recorded as MSBNK-RIKEN_ReSpect-PT110790[25].
  • [3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenyl-N-sulfooxypropanimidothioate's MassBank accession ID is recorded as MSBNK-RIKEN_ReSpect-PT210790[26].

References

Programmatic citations — every numbered marker resolves to a verifiable graph row below.

Direct Wikidata claims

  1. [2] ↑ . wikidata.org.
  2. [3] ↑ . wikidata.org.
  3. [4] ↑ . wikidata.org.
  4. [5] ↑ . wikidata.org.
  5. [6] ↑ . wikidata.org.
  6. [7] ↑ . wikidata.org.
  7. [8] ↑ . PubChem. Retrieved . wikidata.org.
  8. [9] ↑ . A metabolomics approach to identify factors influencing glucosinolate thermal degradation rates in Brassica vegetables. wikidata.org.
  9. [10] ↑ . A metabolomics approach to identify factors influencing glucosinolate thermal degradation rates in Brassica vegetables. wikidata.org.
  10. [11] ↑ . A metabolomics approach to identify factors influencing glucosinolate thermal degradation rates in Brassica vegetables. wikidata.org.
  11. [12] ↑ . Glucosinolates and amines in Reseda media. wikidata.org.
  12. [13] ↑ . Glucosinolates and amines in Reseda media. wikidata.org.
  13. [14] ↑ . Glucosinolates and amines in Reseda media. wikidata.org.
  14. [15] ↑ . Variation of glucosinolates in vegetable crops of Brassica rapa. wikidata.org.
  15. [16] ↑ . A metabolomics approach to identify factors influencing glucosinolate thermal degradation rates in Brassica vegetables. wikidata.org.
  16. [17] ↑ . A metabolomics approach to identify factors influencing glucosinolate thermal degradation rates in Brassica vegetables. wikidata.org.
  17. [18] ↑ . wikidata.org.
  18. [19] ↑ . MassBank/MassBank-data: release version 2022.06 to wikidata. Retrieved . wikidata.org.
  19. [20] ↑ . MassBank/MassBank-data: release version 2022.06 to wikidata. Retrieved . wikidata.org.
  20. [21] ↑ . MassBank/MassBank-data: release version 2022.06 to wikidata. Retrieved . wikidata.org.
  21. [22] ↑ . MassBank/MassBank-data: release version 2022.06 to wikidata. Retrieved . wikidata.org.
  22. [23] ↑ . MassBank/MassBank-data: release version 2022.06 to wikidata. Retrieved . wikidata.org.
  23. [24] ↑ . MassBank/MassBank-data: release version 2022.06 to wikidata. Retrieved . wikidata.org.
  24. [25] ↑ . MassBank/MassBank-data: release version 2022.06 to wikidata. Retrieved . wikidata.org.
  25. [26] ↑ . MassBank/MassBank-data: release version 2022.06 to wikidata. Retrieved . wikidata.org.

Class ancestry

  1. [1] ↑ . Wikidata. wikidata.org.

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