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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 > pestalotiopamide b
organooxygen compound > pestalotiopamide b

Preferred term

pestalotiopamide b  

Type

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

Broader concept

charge

  • 0

formula

  • C12H19NO5

has_functional_parent

inchi

  • InChI=1S/C12H19NO5/c1-9(5-7-18-10(2)14)8-11(15)13-6-3-4-12(16)17/h8H,3-7H2,1-2H3,(H,13,15)(H,16,17)/b9-8+

inchikey

  • MSKRLHVJEKWHJI-CMDGGOBGSA-N

mass

  • 257.286

monoisotopicmass

  • 257.12632

smiles

  • O=C(NCCCC(=O)O)/C=C(/CCOC(=O)C)/C

subset

  • 2_STAR

synonym EXACT

  • 4-[[(E)-5-acetyloxy-3-methylpent-2-enoyl]amino]butanoic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:217001

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