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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > carbohydrates and carbohydrate derivatives > carbohydrate derivative > glycosyl compound > glycoside > cyanogenic glycoside > triglochinin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > cyanides > nitrile > cyanogenic glycoside > triglochinin

Preferred term

triglochinin  

Type

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

Broader concept

charge

  • 0

formula

  • C14H17NO10

inchi

  • InChI=1S/C14H17NO10/c15-4-7(6(3-10(19)20)1-2-9(17)18)24-14-13(23)12(22)11(21)8(5-16)25-14/h1-2,8,11-14,16,21-23H,3,5H2,(H,17,18)(H,19,20)/b2-1-,7-6-/t8-,11-,12+,13-,14-/m1/s1

inchikey

  • LABCALMTQNDOAI-PKNBYVPASA-N

mass

  • 359.286

monoisotopicmass

  • 359.08525

smiles

  • OC[C@H]1O[C@@H](O/C(C#N)=C(CC(O)=O)/C=C/C(O)=O)[C@H](O)[C@@H](O)[C@@H]1O

subset

  • 2_STAR

synonym EXACT

  • Triglochinin

synonym RELATED

  • 2-Hexenedioic acid,4-(cyano(beta-D-glucopyranosyloxy)methylene)-, (E,Z)-

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:9717

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