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Chemistry, part 1

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Concept information

organooxygen compound > carbonyl compound > carboxylic acid > n-acyl-amino acid > spumigin 582b
organooxygen compound > carbon oxoacid > carboxylic acid > n-acyl-amino acid > spumigin 582b
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > oxoacid > carbon oxoacid > carboxylic acid > n-acyl-amino acid > spumigin 582b
... > 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 > spumigin 582b
... > 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 > spumigin 582b
... > 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 > spumigin 582b
organooxygen compound > carboxamide > n-acyl-amino acid > spumigin 582b
... > 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 > spumigin 582b

Preferred term

spumigin 582b  

Type

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

Broader concept

charge

  • 0

formula

  • C30H42N6O6

inchi

  • InChI=1S/C30H42N6O6/c1-19-16-25(27(40)33-14-2-3-15-34-30(31)32)36(18-19)29(42)24(13-8-20-4-9-22(37)10-5-20)35-28(41)26(39)17-21-6-11-23(38)12-7-21/h4-7,9-12,19,24-26,37-39H,2-3,8,13-18H2,1H3,(H,33,40)(H,35,41)(H4,31,32,34)/t19?,24-,25?,26+/m0/s1

inchikey

  • NLJRMAAFNUDGBC-LMOYGDGSSA-N

mass

  • 582.702

monoisotopicmass

  • 582.31658

smiles

  • O=C(NCCCCN=C(N)N)C1N(C(=O)[C@@H](NC(=O)[C@H](O)CC2=CC=C(O)C=C2)CCC3=CC=C(O)C=C3)CC(C1)C

subset

  • 2_STAR

synonym EXACT

  • N-[4-(diaminomethylideneamino)butyl]-1-[(2S)-2-[[(2R)-2-hydroxy-3-(4-hydroxyphenyl)propanoyl]amino]-4-(4-hydroxyphenyl)butanoyl]-4-methylpyrrolidine-2-carboxamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221548

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