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Chemistry, part 1

Content language

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Concept information

... > organooxygen compound > ester > carboxylic ester > amino-acid ester > alpha-amino acid ester > hexose-shinorine
... > organooxygen compound > carbonyl compound > carboxylic ester > amino-acid ester > alpha-amino acid ester > hexose-shinorine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > amino-acid ester > alpha-amino acid ester > hexose-shinorine

Preferred term

hexose-shinorine  

Type

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

Broader concept

charge

  • 0

formula

  • C19H30N2O13

inchi

  • InChI=1S/C19H30N2O13/c1-32-15-8(2-19(31,7-24)3-9(15)21-10(5-22)17(28)29)20-4-12(25)34-16-11(6-23)33-18(30)14(27)13(16)26/h10-11,13-14,16,18,21-24,26-27,30-31H,2-7H2,1H3,(H,28,29)

inchikey

  • RUEKEQPTPAGXDH-UHFFFAOYSA-N

mass

  • 494.450

monoisotopicmass

  • 494.17479

smiles

  • O=C(O)C(NC1=C(OC)C(=NCC(=O)OC2C(O)C(O)C(O)OC2CO)CC(C1)(O)CO)CO

subset

  • 2_STAR

synonym EXACT

  • 3-hydroxy-2-[[5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-[2-oxo-2-[4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyethyl]iminocyclohexen-1-yl]amino]propanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221656

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