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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 > n-[(2r,3s)-2-[[[anilino(oxo)methyl]-methylamino]methyl]-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide
organooxygen compound > n-[(2r,3s)-2-[[[anilino(oxo)methyl]-methylamino]methyl]-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide

Preferred term

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

Type

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

Broader concept

charge

  • 0

formula

  • C30H41N5O6

has_functional_parent

inchi

  • InChI=1S/C30H41N5O6/c1-21-18-35(22(2)20-36)29(38)25-17-24(31-28(37)11-12-34-13-15-40-16-14-34)9-10-26(25)41-27(21)19-33(3)30(39)32-23-7-5-4-6-8-23/h4-10,17,21-22,27,36H,11-16,18-20H2,1-3H3,(H,31,37)(H,32,39)/t21-,22-,27-/m0/s1

inchikey

  • NBWGOUGTHFGVFJ-BERHBOFZSA-N

mass

  • 567.678

monoisotopicmass

  • 567.30568

smiles

  • C[C@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)CCN3CCOCC3)O[C@H]1CN(C)C(=O)NC4=CC=CC=C4)[C@@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:128775

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