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CHEBI:31242 - astromycin sulfate

ChEBI IDCHEBI:31242
ChEBI Nameastromycin sulfate
Stars
Last Modified6 March 2017
DownloadsMolfile
FormulaC17H35N5O6.2H2O4S
Net Charge0
Average Mass601.654
Monoisotopic Mass601.19349
SMILESO=S(=O)(O)O.O=S(=O)(O)O.[H][C@@]1([C@H](C)N)CC[C@@H](N)[C@@H](O[C@@H]2[C@@H](N)[C@H](O)[C@H](OC)[C@@H](N(C)C(=O)CN)[C@H]2O)O1
InChIInChI=1S/C17H35N5O6.2H2O4S/c1-7(19)9-5-4-8(20)17(27-9)28-15-11(21)13(24)16(26-3)12(14(15)25)22(2)10(23)6-18;2*1-5(2,3)4/h7-9,11-17,24-25H,4-6,18-21H2,1-3H3;2*(H2,1,2,3,4)/t7-,8+,9-,11-,12-,13-,14+,15+,16+,17+;;/m0../s1
InChIKeyTYNZVWXDLOJTIM-QQFWICJTSA-N
ChEBI Ontology
Outgoing Relation(s)
astromycin sulfate (CHEBI:31242) has functional parent astromicin (CHEBI:37923)
astromycin sulfate (CHEBI:31242) is a aminoglycoside sulfate salt (CHEBI:38012)
Synonym  Source
Astromicin sulfateKEGG COMPOUND
Manual XrefsDatabases
D01881KEGG DRUG
Registry NumbersSources
CAS:72275-67-3KEGG COMPOUND