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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > lipopeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > lipopeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
organooxygen compound > carboxamide > peptide > lipopeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > lipopeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > lipopeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > lipopeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > polyatomic entity > macromolecule > polypeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > peptide > polypeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
organooxygen compound > carboxamide > peptide > polypeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > polypeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > polypeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > polypeptide > ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee

Preferred term

ac-asp-n(6)-/{3-[2-(trifluoromethyl)phenyl]propanoyl/}-katigfevqee  

Type

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

Broader concept

charge

  • 0

formula

  • C71H101F3N14O25

has_role

inchi

  • InChI=1S/C71H101F3N14O25/c1-8-36(4)58(87-69(111)59(38(6)89)88-60(102)37(5)78-61(103)43(81-66(108)49(33-56(100)101)79-39(7)90)20-14-15-31-76-51(92)27-21-41-18-12-13-19-42(41)71(72,73)74)67(109)77-34-52(93)80-48(32-40-16-10-9-11-17-40)65(107)83-46(24-29-54(96)97)64(106)86-57(35(2)3)68(110)84-44(22-26-50(75)91)62(104)82-45(23-28-53(94)95)63(105)85-47(70(112)113)25-30-55(98)99/h9-13,16-19,35-38,43-49,57-59,89H,8,14-15,20-34H2,1-7H3,(H2,75,91)(H,76,92)(H,77,109)(H,78,103)(H,79,90)(H,80,93)(H,81,108)(H,82,104)(H,83,107)(H,84,110)(H,85,105)(H,86,106)(H,87,111)(H,88,102)(H,94,95)(H,96,97)(H,98,99)(H,100,101)(H,112,113)/t36-,37-,38+,43-,44-,45-,46-,47-,48-,49-,57-,58-,59-/m0/s1

inchikey

  • RWTVPHXIKDJXFS-BMVJGZAPSA-N

mass

  • 1607.63560

monoisotopicmass

  • 1606.70144

smiles

  • CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCCCNC(=O)CCc1ccccc1C(F)(F)F)NC(=O)[C@H](CC(O)=O)NC(C)=O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • N-acetyl-L-alpha-aspartyl-N(6)-{3-[2-(trifluoromethyl)phenyl]propanoyl}-L-lysyl-L-alanyl-L-threonyl-L-isoleucylglycyl-L-phenylalanyl-L-alpha-glutamyl-L-valyl-L-glutaminyl-L-alpha-glutamyl-L-glutamic acid

synonym RELATED

  • Ac-Asp-N(6)-{3-[2-(trifluoromethyl)phenyl]propanoyl}-Lys-Ala-Thr-Ile-Gly-Phe-Glu-Val-Gln-Glu-Glu
  • N-ethanoyl-L-alpha-aspartyl-N(6)-{3-[2-(trifluoromethyl)phenyl]propanoyl}-L-lysyl-L-alanyl-L-threonyl-L-isoleucylglycyl-L-phenylalanyl-L-alpha-glutamyl-L-valyl-L-glutaminyl-L-alpha-glutamyl-L-glutamic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:60238

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