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Concept information

Preferred term

Simplicilliumtide F  

Type

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

Broader concept

charge

  • 0

formula

  • C23H35N3O5

inchi

  • InChI=1S/C23H35N3O5/c1-14(2)12-18(23(30)31)25-21(28)19(13-17-10-8-7-9-11-17)26(6)22(29)20(15(3)4)24-16(5)27/h7-11,14-15,18-20H,12-13H2,1-6H3,(H,24,27)(H,25,28)(H,30,31)/t18-,19+,20?/m0/s1

inchikey

  • OAPXADPUGXUVNF-ABZYKWASSA-N

mass

  • 433.549

monoisotopicmass

  • 433.25767

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-[[(2R)-2-[(2-acetamido-3-methylbutanoyl)-methylamino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209571

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