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CHEBI:31844 - micronomicin sulfate

ChEBI IDCHEBI:31844
ChEBI Namemicronomicin sulfate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC20H41N5O7.H2O4S
Net Charge0
Average Mass561.655
Monoisotopic Mass561.26798
SMILESCNC[C@@H]1CC[C@@H](N)[C@@H](O[C@H]2[C@H](O)[C@@H](O[C@H]3OC[C@](C)(O)[C@H](NC)[C@H]3O)[C@H](N)C[C@@H]2N)O1.O=S(=O)(O)O
InChIInChI=1S/C20H41N5O7.H2O4S/c1-20(28)8-29-19(14(27)17(20)25-3)32-16-12(23)6-11(22)15(13(16)26)31-18-10(21)5-4-9(30-18)7-24-2;1-5(2,3)4/h9-19,24-28H,4-8,21-23H2,1-3H3;(H2,1,2,3,4)/t9-,10+,11-,12+,13-,14+,15+,16-,17+,18+,19+,20-;/m0./s1
InChIKeyMQDGQSCLOYLSEK-SCFBDNQUSA-N
ChEBI Ontology
Outgoing Relation(s)
micronomicin sulfate (CHEBI:31844) has functional parent micronomicin (CHEBI:37988)
micronomicin sulfate (CHEBI:31844) is a aminoglycoside sulfate salt (CHEBI:38012)
Synonym  Source
Micronomicin sulfateKEGG COMPOUND
Manual XrefsDatabases
D01821KEGG DRUG
Registry NumbersSources
CAS:66803-19-8KEGG COMPOUND