skip to main content

Content language

Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

(S) 4 هیدروکسی ماندلونیتریل بتا گلوکوزید  

Type

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

alt_id

  • CHEBI:11051
  • CHEBI:18760
  • CHEBI:407
  • CHEBI:4475

charge

  • 0

formula

  • C14H17NO7

has_functional_parent

inchi

  • InChI=1S/C14H17NO7/c15-5-9(7-1-3-8(17)4-2-7)21-14-13(20)12(19)11(18)10(6-16)22-14/h1-4,9-14,16-20H,6H2/t9-,10-,11-,12+,13-,14-/m1/s1

inchikey

  • NVLTYOJHPBMILU-YOVYLDAJSA-N

mass

  • 311.28732

monoisotopicmass

  • 311.10050

smiles

  • OC[C@H]1O[C@@H](O[C@H](C#N)c2ccc(O)cc2)[C@H](O)[C@@H](O)[C@@H]1O

subset

  • 3_STAR

synonym EXACT

  • (2S)-(beta-D-glucopyranosyloxy)(4-hydroxyphenyl)acetonitrile
  • (S)-4-Hydroxymandelonitrile beta-D-glucoside

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:27826

Download this concept: