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CHEBI:205936 - Bartoloside F

ChEBI IDCHEBI:205936
ChEBI NameBartoloside F
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FormulaC37H64Cl2O6
Net Charge0
Average Mass675.819
Monoisotopic Mass674.40800
SMILESCCCCCCCCC(Cl)CCCCCc1cc(O)c(CCCCCC(Cl)CCCCCC)c(O[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)c1
InChIInChI=1S/C37H64Cl2O6/c1-3-5-7-9-10-15-21-30(39)22-16-11-13-19-28-25-32(40)31(24-18-12-17-23-29(38)20-14-8-6-4-2)34(26-28)45-37-36(43)35(42)33(41)27-44-37/h25-26,29-30,33,35-37,40-43H,3-24,27H2,1-2H3/t29?,30?,33-,35+,36-,37+/m1/s1
InChIKeyIWIZOMWAHIZTOM-ZQWJTRQNSA-N
Species of MetaboliteComponentSourceComments
Synechocystis salina LEGE 06099 (ncbitaxon:945781) - PubMed (27680198)
ChEBI Ontology
Outgoing Relation(s)
Bartoloside F (CHEBI:205936) is a glycoside (CHEBI:24400)
IUPAC Name 
(2S,3R,4S,5R)-2-[2-(6-chlorododecyl)-5-(6-chlorotetradecyl)-3-hydroxyphenoxy]oxane-3,4,5-triol
Manual XrefsDatabases
58197376ChemSpider