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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > oligopeptide > pseudacyclin e
organooxygen compound > carboxamide > peptide > oligopeptide > pseudacyclin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > oligopeptide > pseudacyclin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > oligopeptide > pseudacyclin e
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > oligopeptide > pseudacyclin e

Preferred term

pseudacyclin e  

Type

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

Broader concept

charge

  • 0

formula

  • C37H57N7O7

inchi

  • InChI=1S/C37H57N7O7/c1-8-23(6)31-36(50)42-29(21(2)3)34(48)38-18-12-16-26(40-35(49)30(22(4)5)39-24(7)45)32(46)41-27(20-25-14-10-9-11-15-25)37(51)44-19-13-17-28(44)33(47)43-31/h9-11,14-15,21-23,26-31H,8,12-13,16-20H2,1-7H3,(H,38,48)(H,39,45)(H,40,49)(H,41,46)(H,42,50)(H,43,47)/t23-,26-,27+,28-,29-,30-,31-/m0/s1

inchikey

  • KGWMDHGTMDDFCU-WAVVYUKHSA-N

mass

  • 711.905

monoisotopicmass

  • 711.43195

smiles

  • O=C1N2[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)NCCC[C@@H](C(N[C@@H]1CC3=CC=CC=C3)=O)NC(=O)[C@@H](NC(=O)C)C(C)C)C(C)C)[C@H](CC)C)CCC2

subset

  • 2_STAR

synonym EXACT

  • (2S)-2-acetamido-N-[(3R,6S,12S,15S,18S)-3-benzyl-15-[(2S)-butan-2-yl]-2,5,11,14,17-pentaoxo-12-propan-2-yl-1,4,10,13,16-pentazabicyclo[16.3.0]henicosan-6-yl]-3-methylbutanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225456

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