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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 > carbon group molecular entity > organic molecular entity > organic amino compound > amine > alkylamines > aralkylamine > preubetain i
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > amine > alkylamines > aralkylamine > preubetain i
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > aralkylamino compound > aralkylamine > preubetain i
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > aralkylamino compound > aralkylamine > preubetain i

Preferred term

preubetain i  

Type

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

Broader concept

charge

  • 0

formula

  • C21H35NO2

inchi

  • InChI=1S/C21H35NO2/c1-3-19(23)14-10-5-4-9-13-18-16-21(24)20(22(18)2)15-17-11-7-6-8-12-17/h6-8,11-12,18-21,23-24H,3-5,9-10,13-16H2,1-2H3/t18-,19-,20+,21+/m1/s1

inchikey

  • CJSSSEJSBABUJE-CGXNFDGLSA-N

mass

  • 333.516

monoisotopicmass

  • 333.26678

smiles

  • O[C@@H]1[C@@H](N(C)[C@@H](C1)CCCCCC[C@H](O)CC)CC2=CC=CC=C2

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,5R)-2-benzyl-5-[(7R)-7-hydroxynonyl]-1-methylpyrrolidin-3-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:208277

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