EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:31475 - dibekacin sulfate

ChEBI IDCHEBI:31475
ChEBI Namedibekacin sulfate
Stars
Last Modified19 February 2019
DownloadsMolfile
Formula(H2O4S)n.C18H37N5O8
Net Charge0
Average Mass549.600
Monoisotopic Mass549.23159
SMILESNC[C@@H]1CC[C@@H](N)[C@@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](N)[C@H]3O)[C@H](N)C[C@@H]2N)O1.O=S(=O)(O)O
InChIInChI=1S/C18H37N5O8.H2O4S/c19-4-6-1-2-7(20)17(28-6)30-15-8(21)3-9(22)16(14(15)27)31-18-13(26)11(23)12(25)10(5-24)29-18;1-5(2,3)4/h6-18,24-27H,1-5,19-23H2;(H2,1,2,3,4)/t6-,7+,8-,9+,10+,11-,12+,13+,14-,15+,16-,17+,18+;/m0./s1
InChIKeyGXKUKBCVZHBTJW-USXQJGOZSA-N
ChEBI Ontology
Outgoing Relation(s)
dibekacin sulfate (CHEBI:31475) has functional parent dibekacin (CHEBI:37945)
dibekacin sulfate (CHEBI:31475) is a aminoglycoside sulfate salt (CHEBI:38012)
Synonym  Source
PanimycinKEGG DRUG
Manual XrefsDatabases
D01753KEGG DRUG
Registry NumbersSources
CAS:58580-55-5KEGG DRUG