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CHEBI:225816 - methyl 20(21)-dehydrolucidenate A

ChEBI IDCHEBI:225816
ChEBI Namemethyl 20(21)-dehydrolucidenate A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H38O6
Net Charge0
Average Mass470.606
Monoisotopic Mass470.26684
SMILESC=C(CCC(=O)OC)[C@H]1CC(=O)[C@@]2(C)C3=C(C(=O)C[C@]12C)[C@@]1(C)CCC(=O)C(C)(C)[C@@H]1C[C@@H]3O
InChIInChI=1S/C28H38O6/c1-15(8-9-22(33)34-7)16-12-21(32)28(6)24-17(29)13-19-25(2,3)20(31)10-11-26(19,4)23(24)18(30)14-27(16,28)5/h16-17,19,29H,1,8-14H2,2-7H3/t16-,17+,19+,26+,27-,28+/m1/s1
InChIKeyWISYORQOKQXQDW-LCTKWGEDSA-N
Species of MetaboliteComponentSourceComments
Ganoderma lucidum (ncbitaxon:5315) - PubMed (15844948)
ChEBI Ontology
Outgoing Relation(s)
methyl 20(21)-dehydrolucidenate A (CHEBI:225816) is a 11-oxo steroid (CHEBI:47787)
IUPAC Name 
methyl 4-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]pent-4-enoate
Manual XrefsDatabases
9330749ChemSpider