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Concept information

Preferred term

Asp Asp Tyr  

Type

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

Broader concept

charge

  • 0

formula

  • C17H21N3O9

inchi

  • InChI=1S/C17H21N3O9/c18-10(6-13(22)23)15(26)19-11(7-14(24)25)16(27)20-12(17(28)29)5-8-1-3-9(21)4-2-8/h1-4,10-12,21H,5-7,18H2,(H,19,26)(H,20,27)(H,22,23)(H,24,25)(H,28,29)/t10-,11-,12-/m0/s1

inchikey

  • VZNOVQKGJQJOCS-SRVKXCTJSA-N

mass

  • 411.367

monoisotopicmass

  • 411.12778

smiles

  • O=C(N[C@@H](CC1=CC=C(O)C=C1)C(O)=O)[C@@H](NC(=O)[C@@H](N)CC(O)=O)CC(O)=O

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-amino-4-[[(2S)-3-carboxy-1-[[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:160433

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