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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 > cyclic peptide > mbj-0174
organooxygen compound > carboxamide > peptide > cyclic peptide > mbj-0174
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > peptide > cyclic peptide > mbj-0174
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > peptide > cyclic peptide > mbj-0174
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > peptide > cyclic peptide > mbj-0174

Preferred term

mbj-0174  

Type

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

Broader concept

charge

  • 0

formula

  • C31H50N8O6

inchi

  • InChI=1S/C31H50N8O6/c1-16(2)14-22-28(43)39-25(18(5)6)30(45)37-23(15-19-9-11-20(40)12-10-19)27(42)35-21(8-7-13-34-31(32)33)26(41)38-24(17(3)4)29(44)36-22/h9-12,16-18,21-25,40H,7-8,13-15H2,1-6H3,(H,35,42)(H,36,44)(H,37,45)(H,38,41)(H,39,43)(H4,32,33,34)/t21-,22+,23+,24-,25-/m1/s1

inchikey

  • DOAPOAHOZVKNLQ-ZLOLNMDISA-N

mass

  • 630.791

monoisotopicmass

  • 630.38533

smiles

  • O=C1N[C@H](C(=O)N[C@@H](C(=O)N[C@@H](C(N[C@H](C(N[C@@H]1C(C)C)=O)CC(C)C)=O)C(C)C)CCCN=C(N)N)CC2=CC=C(O)C=C2

subset

  • 2_STAR

synonym EXACT

  • 2-[3-[(2R,5R,8S,11R,14S)-14-[(4-hydroxyphenyl)methyl]-8-(2-methylpropyl)-3,6,9,12,15-pentaoxo-5,11-di(propan-2-yl)-1,4,7,10,13-pentazacyclopentadec-2-yl]propyl]guanidine

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225859

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