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CHEBI:198616 - 4-epi-8alpha-hydroxy-15-epi-brefeldin C

ChEBI IDCHEBI:198616
ChEBI Name4-epi-8alpha-hydroxy-15-epi-brefeldin C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H24O4
Net Charge0
Average Mass280.364
Monoisotopic Mass280.16746
SMILESC[C@@H]1CCC/C=C/[C@H]2[C@@H](CC[C@H]2O)[C@@H](O)/C=C/C(=O)O1
InChIInChI=1S/C16H24O4/c1-11-5-3-2-4-6-12-13(7-8-14(12)17)15(18)9-10-16(19)20-11/h4,6,9-15,17-18H,2-3,5,7-8H2,1H3/b6-4+,10-9+/t11-,12+,13-,14-,15+/m1/s1
InChIKeyDTUZEFPEIMVBAJ-NCCFWWCZSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (27067647)
ChEBI Ontology
Outgoing Relation(s)
4-epi-8alpha-hydroxy-15-epi-brefeldin C (CHEBI:198616) is a macrolide (CHEBI:25106)
IUPAC Name 
(1R,2S,3E,7R,11E,13S,14R)-2,14-dihydroxy-7-methyl-6-oxabicyclo[11.3.0]hexadeca-3,11-dien-5-one
Manual XrefsDatabases
58197211ChemSpider