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Chemistry, part 2

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 > crinamabine trifluoroacetic acid

Preferred term

crinamabine trifluoroacetic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C18H20F3NO7

has_role

inchi

  • InChI=1S/C16H19NO5.C2HF3O2/c18-11-1-2-16(20)15(14(11)19)3-4-17(16)7-9-5-12-13(6-10(9)15)22-8-21-12;3-2(4,5)1(6)7/h5-6,11,14,18-20H,1-4,7-8H2;(H,6,7)/t11-,14-,15+,16-;/m0./s1

inchikey

  • UBPSZAPZJVBEAU-CHIYLFTISA-N

mass

  • 419.34910

monoisotopicmass

  • 419.11919

smiles

  • OC(=O)C(F)(F)F.O[C@H]1CC[C@@]2(O)N3CC[C@]2([C@H]1O)c1cc2OCOc2cc1C3

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68313

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