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CHEBI:207687 - Mycinamicin IX

ChEBI IDCHEBI:207687
ChEBI NameMycinamicin IX
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC36H59NO12
Net Charge0
Average Mass697.863
Monoisotopic Mass697.40373
SMILESCC[C@H]1OC(=O)C=C[C@H](C)[C@@H](O[C@@H]2O[C@H](C)CC(N(C)C)C2O)[C@H](C)C[C@@H](C)C(=O)C=CC=C[C@]1(O)CO[C@@H]1OC(C)[C@H](O)[C@H](O)[C@@H]1OC
InChIInChI=1S/C36H59NO12/c1-10-27-36(43,19-45-35-33(44-9)31(42)29(40)24(6)47-35)16-12-11-13-26(38)21(3)17-22(4)32(20(2)14-15-28(39)48-27)49-34-30(41)25(37(7)8)18-23(5)46-34/h11-16,20-25,27,29-35,40-43H,10,17-19H2,1-9H3/t20-,21+,22+,23+,24?,25?,27+,29-,30?,31-,32+,33-,34-,35+,36-/m0/s1
InChIKeyOFHKOQIHROPJCK-NMPCXYRHSA-N
Species of MetaboliteComponentSourceComments
Micromonospora (ncbitaxon:1873) - PubMed (1761425)
ChEBI Ontology
Outgoing Relation(s)
Mycinamicin IX (CHEBI:207687) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
(5S,6S,7R,9R,15S,16R)-15-[[(2R,3S,4S,5R)-4,5-dihydroxy-3-methoxy-6-methyloxan-2-yl]oxymethyl]-6-[(2S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-16-ethyl-15-hydroxy-5,7,9-trimethyl-1-oxacyclohexadeca-3,11,13-triene-2,10-dione