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CHEBI:221241 - Sporeamicin A

ChEBI IDCHEBI:221241
ChEBI NameSporeamicin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC37H63NO12
Net Charge0
Average Mass713.906
Monoisotopic Mass713.43503
SMILESCC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H](N(C)C)[C@H]2O)[C@](C)(O)C[C@@H](C)C2=C(C)C(=O)[C@]1(C)O2
InChIInChI=1S/C37H63NO12/c1-14-25-37(10)30(40)20(4)28(50-37)18(2)16-35(8,43)32(49-34-27(39)24(38(11)12)15-19(3)45-34)21(5)29(22(6)33(42)47-25)48-26-17-36(9,44-13)31(41)23(7)46-26/h18-19,21-27,29,31-32,34,39,41,43H,14-17H2,1-13H3/t18-,19-,21+,22-,23+,24+,25-,26+,27-,29+,31+,32-,34+,35-,36-,37-/m1/s1
InChIKeySZZIJYBWFJCYOX-DHWUZCQFSA-N
Species of MetaboliteComponentSourceComments
Saccharopolyspora (ncbitaxon:1835) - PubMed (1624360)
ChEBI Ontology
Outgoing Relation(s)
Sporeamicin A (CHEBI:221241) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
(1R,2R,5R,6S,7S,8R,9R,11R)-8-[(2S,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-2-ethyl-9-hydroxy-6-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-1,5,7,9,11,13-hexamethyl-3,15-dioxabicyclo[10.2.1]pentadec-12-ene-4,14-dione
Manual XrefsDatabases
7986180ChemSpider