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CHEBI:205380 - Alternaroside C

ChEBI IDCHEBI:205380
ChEBI NameAlternaroside C
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SubmitterMetaboLights
DownloadsMolfile
FormulaC42H77NO9
Net Charge0
Average Mass740.076
Monoisotopic Mass739.55983
SMILESCCCCCCCCC/C=C\CC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](O)/C=C/CCCCCCCCCCCCCC
InChIInChI=1S/C42H77NO9/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-36(46)41(50)43-34(33-51-42-40(49)39(48)38(47)37(32-44)52-42)35(45)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h20,22,28-31,34-40,42,44-49H,3-19,21,23-27,32-33H2,1-2H3,(H,43,50)/b22-20-,30-28+,31-29+/t34-,35+,36+,37+,38+,39-,40+,42+/m0/s1
InChIKeyGITZFVKUUYAFTR-VMELUKIZSA-N
Species of MetaboliteComponentSourceComments
Alternaria japonica (ncbitaxon:119919) - PubMed (19685913)
ChEBI Ontology
Outgoing Relation(s)
Alternaroside C (CHEBI:205380) is a glycosylceramide (CHEBI:62941)
IUPAC Name 
(E,2R)-2-hydroxy-N-[(2S,3R,4E,8Z)-3-hydroxy-1-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadeca-4,8-dien-2-yl]octadec-3-enamide
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24656879ChemSpider