EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:7529 - netilmicin sulfate

ChEBI IDCHEBI:7529
ChEBI Namenetilmicin sulfate
Stars
Last Modified6 March 2017
DownloadsMolfile
Formula2C21H41N5O7.5H2O4S
Net Charge0
Average Mass1441.569
Monoisotopic Mass1440.43810
SMILESCCN[C@@H]1C[C@H](N)[C@@H](O[C@H]2OC(CN)=CC[C@H]2N)[C@H](O)[C@H]1O[C@H]1OC[C@](C)(O)[C@H](NC)[C@H]1O.CCN[C@@H]1C[C@H](N)[C@@H](O[C@H]2OC(CN)=CC[C@H]2N)[C@H](O)[C@H]1O[C@H]1OC[C@](C)(O)[C@H](NC)[C@H]1O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O.O=S(=O)(O)O
InChIInChI=1S/2C21H41N5O7.5H2O4S/c2*1-4-26-13-7-12(24)16(32-19-11(23)6-5-10(8-22)31-19)14(27)17(13)33-20-15(28)18(25-3)21(2,29)9-30-20;5*1-5(2,3)4/h2*5,11-20,25-29H,4,6-9,22-24H2,1-3H3;5*(H2,1,2,3,4)/t2*11-,12+,13-,14+,15-,16-,17+,18-,19-,20-,21+;;;;;/m11...../s1
InChIKeyAGFWIZQEWFGATK-UNZHCMSXSA-N
ChEBI Ontology
Outgoing Relation(s)
netilmicin sulfate (CHEBI:7529) has functional parent netilmycin (CHEBI:7528)
netilmicin sulfate (CHEBI:7529) is a aminoglycoside sulfate salt (CHEBI:38012)
Synonym  Source
Netilmicin sulfateKEGG COMPOUND
Manual XrefsDatabases
D00867KEGG DRUG
Registry NumbersSources
CAS:56391-57-2KEGG COMPOUND