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Chemistry, part 3

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > nitro compound > c-nitro compound > ayamycin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > c-nitro compound > ayamycin
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > ayamycin

Preferred term

ayamycin  

Type

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

Broader concept

charge

  • 0

formula

  • C14H17Cl2NO3

inchi

  • InChI=1S/C14H17Cl2NO3/c1-3-10(8-13(18)14(15)16)9(2)11-4-6-12(7-5-11)17(19)20/h4-7,9-10,14H,3,8H2,1-2H3/t9-,10-/m0/s1

inchikey

  • YJUBDQRBJQTJHH-UWVGGRQHSA-N

mass

  • 318.190

monoisotopicmass

  • 317.05855

smiles

  • ClC(Cl)C(=O)C[C@@H]([C@@H](C1=CC=C([N+](=O)[O-])C=C1)C)CC

subset

  • 2_STAR

synonym EXACT

  • (4S,5S)-1,1-dichloro-4-ethyl-5-(4-nitrophenyl)hexan-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209657

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