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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > mycosporine hydroxyglutamicol
organooxygen compound > mycosporine hydroxyglutamicol

Preferred term

mycosporine hydroxyglutamicol  

Type

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

Broader concept

charge

  • 0

formula

  • C13H21NO8

has_functional_parent

inchi

  • InChI=1S/C13H21NO8/c1-22-12-7(3-13(21,6-16)4-10(12)18)14-8(5-15)9(17)2-11(19)20/h8-9,14-17,21H,2-6H2,1H3,(H,19,20)

inchikey

  • WAMMVUHUQUSYRL-UHFFFAOYSA-N

mass

  • 319.310

monoisotopicmass

  • 319.12672

smiles

  • O=C1C(OC)=C(NC(C(O)CC(=O)O)CO)CC(C1)(O)CO

subset

  • 2_STAR

synonym EXACT

  • 3,5-dihydroxy-4-[[5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-oxocyclohexen-1-yl]amino]pentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:204315

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