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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-10-yl]-4-pyridinecarboxamide

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-10-yl]-4-pyridinecarboxamide  

Type

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

Broader concept

charge

  • 0

formula

  • C30H35N5O6

inchi

  • InChI=1S/C30H35N5O6/c1-19-16-35(20(2)18-36)29(38)24-6-5-7-25(33-28(37)21-12-14-31-15-13-21)27(24)41-26(19)17-34(3)30(39)32-22-8-10-23(40-4)11-9-22/h5-15,19-20,26,36H,16-18H2,1-4H3,(H,32,39)(H,33,37)/t19-,20+,26-/m1/s1

inchikey

  • YPMOLAXPZMKSMS-BVFVYWQFSA-N

mass

  • 561.630

monoisotopicmass

  • 561.25873

smiles

  • C[C@@H]1CN(C(=O)C2=C(C(=CC=C2)NC(=O)C3=CC=NC=C3)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:111598

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