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

Preferred term

qinichelin  

Type

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

Broader concept

charge

  • 0

formula

  • C31H49N9O14

inchi

  • InChI=1S/C31H49N9O14/c32-10-2-7-18(34-28(49)20(13-41)36-25(46)16-5-1-9-23(44)24(16)45)27(48)37-21(14-42)29(50)38-22(15-43)31(52)40(54)11-3-6-17(33)26(47)35-19-8-4-12-39(53)30(19)51/h1,5,9,17-22,41-45,53-54H,2-4,6-8,10-15,32-33H2,(H,34,49)(H,35,47)(H,36,46)(H,37,48)(H,38,50)/t17-,18-,19-,20+,21+,22-/m0/s1

inchikey

  • SSYRELOFMYAWQU-PZENNZQWSA-N

mass

  • 771.782

monoisotopicmass

  • 771.33990

smiles

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

subset

  • 2_STAR

synonym EXACT

  • N-[(2R)-1-[[(2S)-5-amino-1-[[(2R)-1-[[(2S)-1-[[(4S)-4-amino-5-[[(3S)-1-hydroxy-2-oxopiperidin-3-yl]amino]-5-oxopentyl]-hydroxyamino]-3-hydroxy-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]-2,3-dihydroxybenzamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219028

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