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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 > amine > alkylamines > aralkylamine > asperidine a
... > 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 > asperidine a
... > 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 > asperidine a
... > 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 > asperidine a

Preferred term

asperidine a  

Type

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

Broader concept

charge

  • 0

formula

  • C18H29NO

inchi

  • InChI=1S/C18H29NO/c1-2-3-4-5-9-12-16-14-18(20)17(19-16)13-15-10-7-6-8-11-15/h6-8,10-11,16-20H,2-5,9,12-14H2,1H3/t16-,17+,18+/m1/s1

inchikey

  • ZWOWUVBTGMGXFA-SQNIBIBYSA-N

mass

  • 275.436

monoisotopicmass

  • 275.22491

smiles

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

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,5R)-2-benzyl-5-heptylpyrrolidin-3-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215474

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