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CHEBI:205303 - 3-epifusicoccin Q

ChEBI IDCHEBI:205303
ChEBI Name3-epifusicoccin Q
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H42O9
Net Charge0
Average Mass498.613
Monoisotopic Mass498.28288
SMILESCC(C)C1=C2[C@@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)[C@H](O)[C@H](C)[C@@H]3CC[C@@H](CO)/C3=C/[C@@]2(C)[C@@H](O)C1
InChIInChI=1S/C26H42O9/c1-11(2)15-7-18(29)26(4)8-16-13(9-27)5-6-14(16)12(3)20(30)24(19(15)26)35-25-23(33)22(32)21(31)17(10-28)34-25/h8,11-14,17-18,20-25,27-33H,5-7,9-10H2,1-4H3/b16-8-/t12-,13+,14+,17-,18+,20-,21-,22+,23-,24-,25-,26+/m1/s1
InChIKeyFWRFNWPJPOPNDJ-UIJCHGFXSA-N
Species of MetaboliteComponentSourceComments
Fusicoccum (ncbitaxon:83176) - PubMed (12506972)
ChEBI Ontology
Outgoing Relation(s)
3-epifusicoccin Q (CHEBI:205303) is a diterpene glycoside (CHEBI:71939)
IUPAC Name 
(2S,3R,4S,5S,6R)-2-[[(1E,3R,4S,8R,9R,10R,11S,14R)-4,9-dihydroxy-14-(hydroxymethyl)-3,10-dimethyl-6-propan-2-yl-8-tricyclo[9.3.0.03,7]tetradeca-1,6-dienyl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Manual XrefsDatabases
78437265ChemSpider