**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

3-oxociprofloxacin

Properties Image MNX_ID MNXM1377954 reference chebi:192773 formula C17H16FN3O4 global charge 0 mol weight 345.33 InChIKey MYYZZOHRULFPOQ-UHFFFAOYSA-N InChI InChI=1S/C17H16FN3O4/c18-12-5-10-13(6-14(12)20-4-3-19-15(22)8-20)21(9-1-2-9)7-11(16(10)23)17(24)25/h5-7,9H,1-4,8H2,(H,19,22)(H,24,25) SMILES O=C1CN(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)CCN1 MNX internals InChI (mnx) InChI=1/C17H16FN3O4/c18-12-5-10-13(6-14(12)20-4-3-19-15(22)8-20)21(9-1-2-9)7-11(16(10)23)17(24)25/h5-7,9H,1-4,8H2,(H,19,22)(H,24,25) SMILES (mnx) [CH2:1]1[CH2:2][CH:9]1[n:21]1[cH:7][c:11]([C:17](=[O:24])[OH:25])[c:16](=[O:23])[c:10]2[cH:5][c:12]([F:18])[c:14]([N:20]3[CH2:4][CH2:3][NH:19][C:15](=[O:22])[CH2:8]3)[cH:6][c:13]21

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 2 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
reactome:R-ALL-9794837 reactome:R-ALL-9795154 CHEBI:192773 chebi:192773 MYYZZOHRULFPOQ-UHFFFAOYSA-N	3-oxociprofloxacin
hmdb:HMDB0255992 MYYZZOHRULFPOQ-UHFFFAOYSA-N	Oxociprofloxacin 1-Cyclopropyl-6-fluoro-7-(5-hydroxy-1,2,3,6-tetrahydropyrazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylate 1-cyclopropyl-6-fluoro-4-oxo-7-(3-oxopiperazin-1-yl)-1,4-dihydroquinoline-3-carboxylic acid 1-cyclopropyl-6-fluoro-4-oxo-7-(3-oxopiperazin-1-yl)quinoline-3-carboxylic acid BAY-Q 3542 BAY-Q-3542 oxo-Ciprofloxacin
vmhM:ocpfxn vmhM:ocpfxn vmhmetabolite:ocpfxn vmhmetabolite:ocpfxn MYYZZOHRULFPOQ-UHFFFAOYSA-M	oxociprofloxacin
vmhM:M_ocpfxn	secondary/obsolete/fantasy identifier