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Concept information

Preferred term

(1s,2r,4r)-cinflubrolin  

Type

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

charge

  • 0

formula

  • C17H22BrFO2

inchi

  • InChI=1S/C17H22BrFO2/c1-11(2)17-8-7-16(3,21-17)15(9-17)20-10-12-13(18)5-4-6-14(12)19/h4-6,11,15H,7-10H2,1-3H3/t15-,16+,17-/m1/s1

inchikey

  • COHOXAPLFQQAGA-IXDOHACOSA-N

mass

  • 357.263

monoisotopicmass

  • 356.07872

smiles

  • CC(C)[C@]12CC[C@](C)(O1)[C@@H](C2)OCC1=C(F)C=CC=C1Br

subset

  • 3_STAR

synonym EXACT

  • (1S,2R,4R)-2-[(2-bromo-6-fluorobenzyl)oxy]-1-methyl-4-(propan-2-yl)-7-oxabicyclo[2.2.1]heptane

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:229492

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