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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic aromatic compound > quinolines > quinolone > 1-cyclopropyl-6-fluoro-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyloxysulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic aromatic compound > quinolines > quinolone > 1-cyclopropyl-6-fluoro-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyloxysulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinolines > quinolone > 1-cyclopropyl-6-fluoro-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyloxysulfonic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > quinolines > quinolone > 1-cyclopropyl-6-fluoro-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyloxysulfonic acid

Preferred term

1-cyclopropyl-6-fluoro-5-methyl-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carbonyloxysulfonic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C19H22FN3O6S

inchi

  • InChI=1S/C19H22FN3O6S/c1-10-8-22(6-5-21-10)15-7-14-16(11(2)17(15)20)18(24)13(9-23(14)12-3-4-12)19(25)29-30(26,27)28/h7,9-10,12,21H,3-6,8H2,1-2H3,(H,26,27,28)/t10-/m0/s1

inchikey

  • BYDOYCORUDLYGP-JTQLQIEISA-N

mass

  • 439.460

monoisotopicmass

  • 439.121

smiles

  • S(=O)(=O)(OC(=O)C=1C(=O)C2=C(C=C(N3C[C@@H](NCC3)C)C(=C2C)F)N(C1)C4CC4)O

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:143497

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