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Concept information

Preferred term

Einecs 257 383 4  

Type

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

Broader concept

charge

  • 0

formula

  • C30H39N7O6

inchi

  • InChI=1S/C30H39N7O6/c1-18(2)24(26(39)33-21(17-38)15-19-9-5-3-6-10-19)36-27(40)25(22-13-14-32-29(31)34-22)37-30(43)35-23(28(41)42)16-20-11-7-4-8-12-20/h3-12,17-18,21-25H,13-16H2,1-2H3,(H,33,39)(H,36,40)(H,41,42)(H3,31,32,34)(H2,35,37,43)

inchikey

  • BTAKGODFEIZKSQ-UHFFFAOYSA-N

mass

  • 593.685

monoisotopicmass

  • 593.29618

smiles

  • O=C(NC(C(C)C)C(=O)NC(CC1=CC=CC=C1)C=O)C(NC(=O)NC(CC2=CC=CC=C2)C(O)=O)C3NC(=NCC3)N

subset

  • 2_STAR

synonym EXACT

  • 2-[[1-(2-amino-1,4,5,6-tetrahydropyrimidin-6-yl)-2-[[3-methyl-1-oxo-1-[(1-oxo-3-phenylpropan-2-yl)amino]butan-2-yl]amino]-2-oxoethyl]carbamoylamino]-3-phenylpropanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181214

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