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Concept information

Preferred term

NBD N(Me) DbetaA OH  

Type

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

Broader concept

charge

  • 0

formula

  • C14H15N5O8

inchi

  • InChI=1S/C14H15N5O8/c1-18(9(6-11(22)23)14(24)15-5-4-10(20)21)7-2-3-8(19(25)26)13-12(7)16-27-17-13/h2-3,9H,4-6H2,1H3,(H,15,24)(H,20,21)(H,22,23)/t9-/m0/s1

inchikey

  • ZVCZBCQZSKITFI-VIFPVBQESA-N

mass

  • 381.298

monoisotopicmass

  • 381.09206

smiles

  • O=C(NCCC(=O)O)[C@@H](N(C1=CC=C(C=2C1=NON2)[N+]([O-])=O)C)CC(=O)O

subset

  • 3_STAR

synonym EXACT

  • N-methyl-N-(7-nitro-2,1,3-benzoxadiazol-4-yl)-L-alpha-aspartyl-beta-alanine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:139250

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