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CHEBI:224144 - SF-837 A3

ChEBI IDCHEBI:224144
ChEBI NameSF-837 A3
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC41H65NO15
Net Charge0
Average Mass811.963
Monoisotopic Mass811.43542
SMILESCCC(=O)O[C@@H]1CC(=O)O[C@H](C)C/C=C/C=C/C(=O)[C@H](C)C[C@H](CC=O)[C@H](O[C@@H]2O[C@H](C)[C@@H](O[C@H]3C[C@@](C)(O)[C@@H](OC(=O)CC)[C@H](C)O3)[C@H](N(C)C)[C@H]2O)[C@H]1OC
InChIInChI=1S/C41H65NO15/c1-11-30(45)54-29-21-32(47)51-24(4)16-14-13-15-17-28(44)23(3)20-27(18-19-43)37(38(29)50-10)57-40-35(48)34(42(8)9)36(25(5)53-40)56-33-22-41(7,49)39(26(6)52-33)55-31(46)12-2/h13-15,17,19,23-27,29,33-40,48-49H,11-12,16,18,20-22H2,1-10H3/b14-13+,17-15+/t23-,24-,25-,26+,27+,29-,33+,34-,35-,36-,37+,38+,39+,40+,41-/m1/s1
InChIKeyPOOQYAXQHUANTP-BCGBQJBESA-N
Species of MetaboliteComponentSourceComments
Streptomyces mycarofaciens (ncbitaxon:1949) - PubMed (5562044)
ChEBI Ontology
Outgoing Relation(s)
SF-837 A3 (CHEBI:224144) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
[(4R,5S,6S,7R,9R,11E,13E,16R)-6-[(2S,3R,4R,5S,6R)-4-(dimethylamino)-3-hydroxy-5-[(2S,4R,5S,6S)-4-hydroxy-4,6-dimethyl-5-propanoyloxyoxan-2-yl]oxy-6-methyloxan-2-yl]oxy-5-methoxy-9,16-dimethyl-2,10-dioxo-7-(2-oxoethyl)-1-oxacyclohexadeca-11,13-dien-4-yl] propanoate
Manual XrefsDatabases
4949166ChemSpider