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Concept information

Preferred term

Asp Cys Tyr  

Type

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

Broader concept

charge

  • 0

formula

  • C16H21N3O7S

inchi

  • InChI=1S/C16H21N3O7S/c17-10(6-13(21)22)14(23)19-12(7-27)15(24)18-11(16(25)26)5-8-1-3-9(20)4-2-8/h1-4,10-12,20,27H,5-7,17H2,(H,18,24)(H,19,23)(H,21,22)(H,25,26)/t10-,11-,12-/m0/s1

inchikey

  • LXKLDWVHXNZQGB-SRVKXCTJSA-N

mass

  • 399.420

monoisotopicmass

  • 399.11002

smiles

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

subset

  • 2_STAR

synonym EXACT

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

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:160473

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