EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:227784 - Ganoderlactone E

Default Structure
ChEBI IDCHEBI:227784
ChEBI NameGanoderlactone E
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC27H36O7
Net Charge0
Average Mass472.578
Monoisotopic Mass472.24610
SMILESCC1(C)[C@@H](O)CC[C@]2(C)C3=C([C@@H](O)C[C@@H]12)[C@]1(C)C(=O)C[C@H]([C@]2(C)CCC(=O)O2)[C@@]1(C)C(=O)C3=O
InChIInChI=1S/C27H36O7/c1-23(2)14-11-13(28)19-20(24(14,3)9-7-16(23)29)21(32)22(33)26(5)15(12-17(30)27(19,26)6)25(4)10-8-18(31)34-25/h13-16,28-29H,7-12H2,1-6H3/t13-,14-,15+,16-,24-,25-,26-,27-/m0/s1
InChIKeyJLZBFBIKPBNFQN-RYXAYRNZSA-N
Species of MetaboliteComponentSourceComments
Ganoderma lucidum (ncbitaxon:5315) - PubMed (26222905)
ChEBI Ontology
Outgoing Relation(s)
Ganoderlactone E (CHEBI:227784) is a triterpenoid (CHEBI:36615)
IUPAC Name 
(3S,5R,7S,10S,13R,14S,17S)-3,7-dihydroxy-4,4,10,13,14-pentamethyl-17-[(2S)-2-methyl-5-oxooxolan-2-yl]-1,2,3,5,6,7,16,17-octahydrocyclopenta[a]phenanthrene-11,12,15-trione
Manual XrefsDatabases
59000842ChemSpider