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CHEBI:227028 - Sartorypyrone C

ChEBI IDCHEBI:227028
ChEBI NameSartorypyrone C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H38O4
Net Charge0
Average Mass414.586
Monoisotopic Mass414.27701
SMILESCC1=C(Cc2c(O)cc(C)oc2=O)[C@]2(C)CC[C@H]3C(C)(C)[C@@H](O)CC[C@]3(C)[C@H]2CC1
InChIInChI=1S/C26H38O4/c1-15-7-8-21-25(5,18(15)14-17-19(27)13-16(2)30-23(17)29)11-9-20-24(3,4)22(28)10-12-26(20,21)6/h13,20-22,27-28H,7-12,14H2,1-6H3/t20-,21-,22-,25-,26-/m0/s1
InChIKeyPGQIYFXKLHRAJW-GIDZJRPFSA-N
Species of MetaboliteComponentSourceComments
Neosartorya (ncbitaxon:36629) - PubMed (24477284)
ChEBI Ontology
Outgoing Relation(s)
Sartorypyrone C (CHEBI:227028) is a diterpene lactone (CHEBI:49193)
IUPAC Name 
3-[[(4aR,4bR,7S,8aR,10aR)-7-hydroxy-2,4b,8,8,10a-pentamethyl-4,4a,5,6,7,8a,9,10-octahydro-3H-phenanthren-1-yl]methyl]-4-hydroxy-6-methylpyran-2-one
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32674761ChemSpider