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Chemistry, part 3

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 > nitro compound > c-nitro compound > corynecin iii
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > c-nitro compound > corynecin iii
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > corynecin iii

Preferred term

corynecin iii  

Type

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

Broader concept

charge

  • 0

formula

  • C13H18N2O5

inchi

  • InChI=1S/C13H18N2O5/c1-8(2)13(18)14-11(7-16)12(17)9-3-5-10(6-4-9)15(19)20/h3-6,8,11-12,16-17H,7H2,1-2H3,(H,14,18)/t11-,12-/m1/s1

inchikey

  • IUBVSPMUTLUQHL-VXGBXAGGSA-N

mass

  • 282.296

monoisotopicmass

  • 282.12157

smiles

  • O=[N+]([O-])C1=CC=C([C@@H](O)[C@H](NC(=O)C(C)C)CO)C=C1

subset

  • 2_STAR

synonym EXACT

  • N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]-2-methylpropanamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:221114

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