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Chemistry, part 1

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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 > secondary carboxamide > n-acylglycine > protochelin
organooxygen compound > carboxamide > secondary carboxamide > n-acylglycine > protochelin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > secondary carboxamide > n-acylglycine > protochelin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > proteinogenic amino acid derivative > glycine derivative > n-acylglycine > protochelin
... > organooxygen compound > carbonyl compound > carboxylic acid > n-acyl-amino acid > n-acylglycine > protochelin
... > organooxygen compound > carbon oxoacid > carboxylic acid > n-acyl-amino acid > n-acylglycine > protochelin
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > n-acyl-amino acid > n-acylglycine > protochelin
... > chemical entity > molecular entity > main group molecular entity > s-block molecular entity > hydrogen molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > n-acyl-amino acid > n-acylglycine > protochelin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > n-acyl-amino acid > n-acylglycine > protochelin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > n-acyl-amino acid > n-acylglycine > protochelin
organooxygen compound > carboxamide > n-acyl-amino acid > n-acylglycine > protochelin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > n-acyl-amino acid > n-acylglycine > protochelin

Preferred term

protochelin  

Type

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

Broader concept

charge

  • 0

formula

  • C31H36N4O10

inchi

  • InChI=1S/C31H36N4O10/c36-22-12-5-8-18(25(22)39)28(42)32-15-2-1-11-21(35-30(44)20-10-7-14-24(38)27(20)41)31(45)34-17-4-3-16-33-29(43)19-9-6-13-23(37)26(19)40/h5-10,12-14,21,36-41H,1-4,11,15-17H2,(H,32,42)(H,33,43)(H,34,45)(H,35,44)/t21-/m0/s1

inchikey

  • FRTUVWLJPRMTFC-NRFANRHFSA-N

mass

  • 624.647

monoisotopicmass

  • 624.24314

smiles

  • O=C(N[C@H](C(=O)NCCCCNC(=O)C1=C(O)C(O)=CC=C1)CCCCNC(=O)C2=C(O)C(O)=CC=C2)C3=C(O)C(O)=CC=C3

subset

  • 2_STAR

synonym EXACT

  • N-[5-[(2,3-dihydroxybenzoyl)amino]-6-[4-[(2,3-dihydroxybenzoyl)amino]butylamino]-6-oxohexyl]-2,3-dihydroxybenzamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:219946

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