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Concept information

Preferred term

Ala Asp Trp  

Type

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

Broader concept

charge

  • 0

formula

  • C18H22N4O6

inchi

  • InChI=1S/C18H22N4O6/c1-9(19)16(25)21-13(7-15(23)24)17(26)22-14(18(27)28)6-10-8-20-12-5-3-2-4-11(10)12/h2-5,8-9,13-14,20H,6-7,19H2,1H3,(H,21,25)(H,22,26)(H,23,24)(H,27,28)/t9-,13-,14-/m0/s1

inchikey

  • NFDVJAKFMXHJEQ-HERUPUMHSA-N

mass

  • 390.396

monoisotopicmass

  • 390.15393

smiles

  • O=C(N[C@@H](CC=1C=2C(NC1)=CC=CC2)C(O)=O)[C@@H](NC(=O)[C@@H](N)C)CC(O)=O

subset

  • 2_STAR

synonym EXACT

  • (3S)-3-[[(2S)-2-aminopropanoyl]amino]-4-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-oxobutanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:158048

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