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CHEBI:189215 - Antifungal macrolide

ChEBI IDCHEBI:189215
ChEBI NameAntifungal macrolide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H36O6
Net Charge0
Average Mass396.524
Monoisotopic Mass396.25119
SMILES[H][C@@]12CC[C@@]([H])(O1)[C@@H](C)C(=O)O[C@H](CC)C[C@@]1([H])CC[C@]([H])(O1)C(C)C(=O)O[C@@H](CC)C2
InChIInChI=1S/C22H36O6/c1-5-15-11-17-7-9-20(25-17)14(4)22(24)28-16(6-2)12-18-8-10-19(26-18)13(3)21(23)27-15/h13-20H,5-12H2,1-4H3/t13-,14?,15-,16+,17-,18+,19-,20+/m1/s1
InChIKeyVYGSEJPMQXVTNW-UPOFUFPUSA-N
Species of MetaboliteComponentSourceComments
Arabidopsis thaliana (ncbitaxon:3702) leaf (BTO:0000713) MetaboLights (MTBLS3997)
ChEBI Ontology
Outgoing Relation(s)
Antifungal macrolide (CHEBI:189215) is a macrolide (CHEBI:25106)
IUPAC Name 
(1R,2R,5R,7R,10S,14S,16S)-5,14-diethyl-2,11-dimethyl-4,13,19,20-tetraoxatricyclo[14.2.1.17,10]icosane-3,12-dione
Manual XrefsDatabases
78436578ChemSpider