EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:204989 - Mycinamicin XVIII

ChEBI IDCHEBI:204989
ChEBI NameMycinamicin XVIII
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC29H47NO8
Net Charge0
Average Mass537.694
Monoisotopic Mass537.33017
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=C[C@@H]2O[C@@H]2[C@H]1CO
InChIInChI=1S/C29H47NO8/c1-8-23-20(15-31)28-24(37-28)11-10-22(32)17(3)13-18(4)27(16(2)9-12-25(33)36-23)38-29-26(34)21(30(6)7)14-19(5)35-29/h9-12,16-21,23-24,26-29,31,34H,8,13-15H2,1-7H3/t16-,17-,18-,19-,20+,21?,23-,24+,26?,27-,28-,29+/m1/s1
InChIKeyKLZBTEAFUVTFPC-RZIRKPLNSA-N
Species of MetaboliteComponentSourceComments
Micromonospora (ncbitaxon:1873) - PubMed (1761425)
ChEBI Ontology
Outgoing Relation(s)
Mycinamicin XVIII (CHEBI:204989) is a aminoglycoside (CHEBI:47779)
IUPAC Name 
(1R,2S,3R,8R,9S,10R,12R,16S)-9-[(2S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3-ethyl-2-(hydroxymethyl)-8,10,12-trimethyl-4,17-dioxabicyclo[14.1.0]heptadeca-6,14-diene-5,13-dione