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Concept information

Preferred term

L 744,832  

Type

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

alt_id

  • CHEBI:125428

charge

  • 0

formula

  • C26H45N3O6S2

inchi

  • InChI=1S/C26H45N3O6S2/c1-6-19(4)23(28-15-21(27)17-36)16-34-24(14-20-10-8-7-9-11-20)25(30)29-22(12-13-37(5,32)33)26(31)35-18(2)3/h7-11,18-19,21-24,28,36H,6,12-17,27H2,1-5H3,(H,29,30)/t19-,21+,22-,23+,24?/m0/s1

inchikey

  • PGOKBMWPBDRDGN-SIPQYZPLSA-N

mass

  • 559.780

monoisotopicmass

  • 559.27498

smiles

  • CC[C@H](C)[C@@H](COC(CC1=CC=CC=C1)C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)OC(C)C)NC[C@@H](N)CS

subset

  • 3_STAR

synonym EXACT

  • propan-2-yl (2S)-2-(2-{[(2S,3S)-2-{[(2R)-2-amino-3-sulfanylpropyl]amino}-3-methylpentyl]oxy}-3-phenylpropanamido)-4-(methylsulfonyl)butanoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:183636

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