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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 > amide > primary amide > ureas > n-[(2s,3r)-5-[(2s)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide

Preferred term

n-[(2s,3r)-5-[(2s)-1-hydroxypropan-2-yl]-2-[[[(4-methoxyanilino)-oxomethyl]-methylamino]methyl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-8-yl]cyclopropanecarboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C28H36N4O6

inchi

  • InChI=1S/C28H36N4O6/c1-17-14-32(18(2)16-33)27(35)23-13-21(29-26(34)19-5-6-19)9-12-24(23)38-25(17)15-31(3)28(36)30-20-7-10-22(37-4)11-8-20/h7-13,17-19,25,33H,5-6,14-16H2,1-4H3,(H,29,34)(H,30,36)/t17-,18+,25-/m1/s1

inchikey

  • KFKIQILHOYPHKH-FUMQJTLXSA-N

mass

  • 524.610

monoisotopicmass

  • 524.26348

smiles

  • C[C@@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)C3CC3)O[C@@H]1CN(C)C(=O)NC4=CC=C(C=C4)OC)[C@@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:124133

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