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CHEBI:204464 - Epicoccamide D

ChEBI IDCHEBI:204464
ChEBI NameEpicoccamide D
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SubmitterMetaboLights
DownloadsMolfile
FormulaC31H55NO9
Net Charge0
Average Mass585.779
Monoisotopic Mass585.38768
SMILESCC(CCCCCCCCCCCCCCCCO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O)C(O)=C1C(=O)C(C)N(C)C1=O
InChIInChI=1S/C31H55NO9/c1-21(25(34)24-26(35)22(2)32(3)30(24)39)18-16-14-12-10-8-6-4-5-7-9-11-13-15-17-19-40-31-29(38)28(37)27(36)23(20-33)41-31/h21-23,27-29,31,33-34,36-38H,4-20H2,1-3H3/t21?,22?,23-,27-,28+,29+,31-/m1/s1
InChIKeyCAZGEEOKPVVGSL-TWGBMDCUSA-N
Species of MetaboliteComponentSourceComments
Epicoccumspecies (ncbitaxon:1859956) - PubMed (17966985)
ChEBI Ontology
Outgoing Relation(s)
Epicoccamide D (CHEBI:204464) is a O-acyl carbohydrate (CHEBI:52782)
IUPAC Name 
3-[1-hydroxy-2-methyl-18-[(2R,3S,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoctadecylidene]-1,5-dimethylpyrrolidine-2,4-dione
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78437143ChemSpider