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CHEBI:219369 - Epicitreoviridinol

ChEBI IDCHEBI:219369
ChEBI NameEpicitreoviridinol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H30O7
Net Charge0
Average Mass418.486
Monoisotopic Mass418.19915
SMILESCOc1cc(=O)oc(/C=C/C=C/C=C/[C@@]2(C)O[C@]3(C)C(O)[C@@](C)(O[C@@H]3C)[C@@H]2O)c1C
InChIInChI=1S/C23H30O7/c1-14-16(28-18(24)13-17(14)27-6)11-9-7-8-10-12-21(3)19(25)23(5)20(26)22(4,30-21)15(2)29-23/h7-13,15,19-20,25-26H,1-6H3/b8-7+,11-9+,12-10+/t15-,19-,20?,21-,22+,23+/m1/s1
InChIKeyBHMIDMOHWXULQB-GUPZMKATSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - DOI (10.1016/s0040-4039(00)97883-3)
ChEBI Ontology
Outgoing Relation(s)
Epicitreoviridinol (CHEBI:219369) is a oxacycle (CHEBI:38104)
IUPAC Name 
6-[(1E,3E,5E)-6-[(1R,3R,4R,5S,7R)-4,8-dihydroxy-1,3,5,7-tetramethyl-2,6-dioxabicyclo[3.2.1]octan-3-yl]hexa-1,3,5-trienyl]-4-methoxy-5-methylpyran-2-one
Manual XrefsDatabases
78437627ChemSpider