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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 > carbon group molecular entity > organic molecular entity > organic amino compound > tertiary amino compound > ku-60019
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > tertiary amino compound > ku-60019
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > secondary carboxamide > ku-60019
organooxygen compound > carboxamide > secondary carboxamide > ku-60019
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > secondary carboxamide > ku-60019
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organonitrogen heterocyclic compound > oxazinane > morpholines > ku-60019
organic heterocyclic compound > organonitrogen heterocyclic compound > oxazinane > morpholines > ku-60019
organic heterocyclic compound > organic heteromonocyclic compound > oxazinane > morpholines > ku-60019
organic heterocyclic compound > organic heteropolycyclic compound > organic heterotricyclic compound > thioxanthenes > ku-60019
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > sulfur molecular entity > organosulfur compound > organosulfur heterocyclic compound > thioxanthenes > ku-60019
organic heterocyclic compound > organosulfur heterocyclic compound > thioxanthenes > ku-60019

Preferred term

ku-60019  

Type

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

Broader concept

alt_id

  • CHEBI:91416

charge

  • 0

formula

  • C30H33N3O5S

has_role

inchi

  • InChI=1S/C30H33N3O5S/c1-19-16-32(17-20(2)37-19)18-28(35)31-23-6-7-27-22(13-23)12-21-4-3-5-25(30(21)39-27)26-14-24(34)15-29(38-26)33-8-10-36-11-9-33/h3-7,13-15,19-20H,8-12,16-18H2,1-2H3,(H,31,35)/t19-,20+

inchikey

  • SCELLOWTHJGVIC-BGYRXZFFSA-N

mass

  • 547.670

monoisotopicmass

  • 547.21409

smiles

  • C[C@H]1CN(CC(=O)NC2=CC3=C(SC4=C(C3)C=CC=C4C3=CC(=O)C=C(O3)N3CCOCC3)C=C2)C[C@@H](C)O1

subset

  • 3_STAR

synonym EXACT

  • 2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]-N-{5-[6-(morpholin-4-yl)-4-oxo-4H-pyran-2-yl]-9H-thioxanthen-2-yl}acetamide

synonym RELATED

  • KU 60019
  • KU60019

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:228206

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