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Concept information

Preferred term

ایزوبوتیل گلوکوزینولات  

Type

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

charge

  • -1

formula

  • C11H20NO9S2

inchi

  • InChI=1S/C11H21NO9S2/c1-5(2)3-7(12-21-23(17,18)19)22-11-10(16)9(15)8(14)6(4-13)20-11/h5-6,8-11,13-16H,3-4H2,1-2H3,(H,17,18,19)/p-1/b12-7-/t6-,8-,9+,10-,11+/m1/s1

inchikey

  • SKLKAEFXBVWMJP-IIPHORNXSA-M

mass

  • 374.410

monoisotopicmass

  • 374.05850

smiles

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

subset

  • 3_STAR

synonym EXACT

  • 1-S-[(1S)-3-methyl-N-(sulfonatooxy)butanimidoyl]-1-thio-beta-D-glucopyranose

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:36447

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