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Chemistry, part 1

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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 > amino-acid derivative > amino acid amide > 2-fluoro-n-[(2s,3r,6r)-2-(hydroxymethyl)-6-[2-[[2-(4-morpholinyl)-1-oxoethyl]amino]ethyl]-3-oxanyl]benzamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > amino acid amide > 2-fluoro-n-[(2s,3r,6r)-2-(hydroxymethyl)-6-[2-[[2-(4-morpholinyl)-1-oxoethyl]amino]ethyl]-3-oxanyl]benzamide
organooxygen compound > carboxamide > amino acid amide > 2-fluoro-n-[(2s,3r,6r)-2-(hydroxymethyl)-6-[2-[[2-(4-morpholinyl)-1-oxoethyl]amino]ethyl]-3-oxanyl]benzamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > amino acid amide > 2-fluoro-n-[(2s,3r,6r)-2-(hydroxymethyl)-6-[2-[[2-(4-morpholinyl)-1-oxoethyl]amino]ethyl]-3-oxanyl]benzamide

Preferred term

2-fluoro-n-[(2s,3r,6r)-2-(hydroxymethyl)-6-[2-[[2-(4-morpholinyl)-1-oxoethyl]amino]ethyl]-3-oxanyl]benzamide  

Type

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

Broader concept

charge

  • 0

formula

  • C21H30FN3O5

inchi

  • InChI=1S/C21H30FN3O5/c22-17-4-2-1-3-16(17)21(28)24-18-6-5-15(30-19(18)14-26)7-8-23-20(27)13-25-9-11-29-12-10-25/h1-4,15,18-19,26H,5-14H2,(H,23,27)(H,24,28)/t15-,18-,19-/m1/s1

inchikey

  • MSXVOGFBDSGFQQ-ATZDWAIDSA-N

mass

  • 423.479

monoisotopicmass

  • 423.21695

smiles

  • C1C[C@H]([C@H](O[C@H]1CCNC(=O)CN2CCOCC2)CO)NC(=O)C3=CC=CC=C3F

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:120270

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