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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 > baumannoferrin b
organooxygen compound > baumannoferrin b

Preferred term

baumannoferrin b  

Type

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

Broader concept

charge

  • 0

formula

  • C27H44N4O12

has_functional_parent

inchi

  • InChI=1S/C27H44N4O12/c1-2-3-4-5-6-7-8-10-21(33)30(43)16-9-14-29-23(35)18(24(36)37)17-20(32)28-15-12-19(25(38)39)31-22(34)11-13-27(31,42)26(40)41/h18-19,42-43H,2-17H2,1H3,(H,28,32)(H,29,35)(H,36,37)(H,38,39)(H,40,41)

inchikey

  • UKCQMIFZQBMVKR-UHFFFAOYSA-N

mass

  • 616.665

monoisotopicmass

  • 616.29557

smiles

  • O=C1N(C(O)(C(=O)O)CC1)C(C(=O)O)CCNC(=O)CC(C(=O)O)C(=O)NCCCN(O)C(=O)CCCCCCCCC

subset

  • 2_STAR

synonym EXACT

  • 1-[1-carboxy-3-[[3-carboxy-4-[3-[decanoyl(hydroxy)amino]propylamino]-4-oxobutanoyl]amino]propyl]-2-hydroxy-5-oxopyrrolidine-2-carboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199243

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