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Concept information

Preferred term

5-(methylthio)pentyldesulfoglucosinolate  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

charge

  • 0

formula

  • C13H25NO6S2

inchi

  • InChI=1S/C13H25NO6S2/c1-21-6-4-2-3-5-9(14-19)22-13-12(18)11(17)10(16)8(7-15)20-13/h8,10-13,15-19H,2-7H2,1H3/t8-,10-,11+,12-,13+/m1/s1

inchikey

  • HKIBRYCZLMJRFT-ZMHPAJMFSA-N

mass

  • 355.473

monoisotopicmass

  • 355.11233

smiles

  • S([C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)CO)C(=NO)CCCCCSC

subset

  • 3_STAR

synonym EXACT

  • 1-S-[N-hydroxy-6-(methylsulfanyl)hexanimidoyl]-1-thio-beta-D-glucopyranose

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:136950

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