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CHEBI:223769 - Carnemycin E

ChEBI IDCHEBI:223769
ChEBI NameCarnemycin E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H30O7
Net Charge0
Average Mass394.464
Monoisotopic Mass394.19915
SMILESCCC/C=C/C=C/CCc1cc(O)c([C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)c(O)c1
InChIInChI=1S/C21H30O7/c1-2-3-4-5-6-7-8-9-13-10-14(23)17(15(24)11-13)21-20(27)19(26)18(25)16(12-22)28-21/h4-7,10-11,16,18-27H,2-3,8-9,12H2,1H3/b5-4+,7-6+/t16-,18-,19+,20-,21+/m1/s1
InChIKeyVGEIFQKMLUBNQE-JJJLVWMISA-N
Species of MetaboliteComponentSourceComments
Aspergillusspecies (ncbitaxon:5065) - PubMed (31012585)
ChEBI Ontology
Outgoing Relation(s)
Carnemycin E (CHEBI:223769) is a glycoside (CHEBI:24400)
IUPAC Name 
(2S,3R,4R,5S,6R)-2-[2,6-dihydroxy-4-[(3E,5E)-nona-3,5-dienyl]phenyl]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
74832045ChemSpider