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CHEBI:209863 - Flavicerebroside B

ChEBI IDCHEBI:209863
ChEBI NameFlavicerebroside B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC43H79NO9
Net Charge0
Average Mass754.103
Monoisotopic Mass753.57548
SMILESCCCCCCCCCCCCCC/C=C/[C@@H](O)C(=O)N[C@@H](CO[C@@H]1OC(CO)[C@H](O)C(O)C1O)[C@H](O)/C=C/CC/C=C(\C)CCCCCCCCC
InChIInChI=1S/C43H79NO9/c1-4-6-8-10-12-13-14-15-16-17-18-20-22-26-31-37(47)42(51)44-35(33-52-43-41(50)40(49)39(48)38(32-45)53-43)36(46)30-27-23-25-29-34(3)28-24-21-19-11-9-7-5-2/h26-27,29-31,35-41,43,45-50H,4-25,28,32-33H2,1-3H3,(H,44,51)/b30-27+,31-26+,34-29+/t35-,36+,37+,38?,39-,40?,41?,43+/m0/s1
InChIKeyQSPMXWIFLDIBGD-QVCLNRSTSA-N
Species of MetaboliteComponentSourceComments
Aspergillus flavipes (ncbitaxon:41900) - PubMed (15621583)
ChEBI Ontology
Outgoing Relation(s)
Flavicerebroside B (CHEBI:209863) is a glycosylceramide (CHEBI:62941)
IUPAC Name 
(E,2R)-2-hydroxy-N-[(2S,3R,4E,8E)-3-hydroxy-9-methyl-1-[(2R,5R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,8-dien-2-yl]octadec-3-enamide
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