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Concept information

Preferred term

Asp Asp Thr  

Type

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

Broader concept

charge

  • 0

formula

  • C12H19N3O9

inchi

  • InChI=1S/C12H19N3O9/c1-4(16)9(12(23)24)15-11(22)6(3-8(19)20)14-10(21)5(13)2-7(17)18/h4-6,9,16H,2-3,13H2,1H3,(H,14,21)(H,15,22)(H,17,18)(H,19,20)(H,23,24)/t4-,5+,6+,9+/m1/s1

inchikey

  • BFOYULZBKYOKAN-OLHMAJIHSA-N

mass

  • 349.296

monoisotopicmass

  • 349.11213

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-amino-4-[[(2S)-3-carboxy-1-[[(1S,2R)-1-carboxy-2-hydroxypropyl]amino]-1-oxopropan-2-yl]amino]-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:160429

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