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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > addition compound > hydrate > peramivir hydrate

Preferred term

peramivir hydrate  

Type

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

Broader concept

charge

  • 0

formula

  • C15H36N4O8

has_role

inchi

  • InChI=1S/C15H28N4O4.4H2O/c1-4-8(5-2)12(18-7(3)20)11-10(19-15(16)17)6-9(13(11)21)14(22)23;;;;/h8-13,21H,4-6H2,1-3H3,(H,18,20)(H,22,23)(H4,16,17,19);4*1H2/t9-,10+,11+,12-,13+;;;;/m0..../s1

inchikey

  • UGTYTOKVOXBJBZ-LINPMSLLSA-N

mass

  • 400.46830

monoisotopicmass

  • 400.25331

smiles

  • O.O.O.O.CCC(CC)[C@H](NC(C)=O)[C@@H]1[C@H](O)[C@H](C[C@H]1NC(N)=N)C(O)=O

subset

  • 3_STAR

synonym EXACT

  • (1S,2S,3R,4R)-3-[(1S)-1-acetamido-2-ethylbutyl]-4-carbamimidamido-2-hydroxycyclopentane-1-carboxylic acid--water (1/3)

synonym RELATED

  • peramivir
  • Peramivir trihydrate
  • RAPIVAB

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:85196

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