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CHEBI:205266 - Phyllostictine C

ChEBI IDCHEBI:205266
ChEBI NamePhyllostictine C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H27NO6
Net Charge0
Average Mass341.404
Monoisotopic Mass341.18384
SMILESC=C1C2=C(C(=O)N1OC)[C@H](O)[C@](O)(CO)[C@H](CCCCCCC)O2
InChIInChI=1S/C17H27NO6/c1-4-5-6-7-8-9-12-17(22,10-19)15(20)13-14(24-12)11(2)18(23-3)16(13)21/h12,15,19-20,22H,2,4-10H2,1,3H3/t12-,15-,17-/m0/s1
InChIKeyOMFBMAYQAGJDSA-NUTKFTJISA-N
Species of MetaboliteComponentSourceComments
Phyllosticta cirsii (ncbitaxon:1986016) - DOI (10.1016/j.tet.2007.12.010)
ChEBI Ontology
Outgoing Relation(s)
Phyllostictine C (CHEBI:205266) is a pyrroline (CHEBI:23763)
IUPAC Name 
(2S,3R,4S)-2-heptyl-3,4-dihydroxy-3-(hydroxymethyl)-6-methoxy-7-methylidene-2,4-dihydropyrano[2,3-c]pyrrol-5-one