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Concept information

Preferred term

Asp Glu Tyr  

Type

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

Broader concept

charge

  • 0

formula

  • C18H23N3O9

inchi

  • InChI=1S/C18H23N3O9/c19-11(8-15(25)26)16(27)20-12(5-6-14(23)24)17(28)21-13(18(29)30)7-9-1-3-10(22)4-2-9/h1-4,11-13,22H,5-8,19H2,(H,20,27)(H,21,28)(H,23,24)(H,25,26)(H,29,30)/t11-,12-,13-/m0/s1

inchikey

  • RRKCPMGSRIDLNC-AVGNSLFASA-N

mass

  • 425.394

monoisotopicmass

  • 425.14343

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)CCC(O)=O

subset

  • 2_STAR

synonym EXACT

  • (4S)-4-[[(2S)-2-amino-3-carboxypropanoyl]amino]-5-[[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]amino]-5-oxopentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:160549

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