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CHEBI:227864 - (22E,24R)-ergosta-7,22-dien-3beta,5alpha-diol-6,5-olide

ChEBI IDCHEBI:227864
ChEBI Name(22E,24R)-ergosta-7,22-dien-3beta,5alpha-diol-6,5-olide
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H44O4
Net Charge0
Average Mass444.656
Monoisotopic Mass444.32396
SMILESCC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@H]2C3=CC(=O)O[C@@]4(O)C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
InChIInChI=1S/C28H44O4/c1-17(2)18(3)7-8-19(4)22-9-10-23-21-15-25(30)32-28(31)16-20(29)11-14-27(28,6)24(21)12-13-26(22,23)5/h7-8,15,17-20,22-24,29,31H,9-14,16H2,1-6H3/b8-7+/t18-,19+,20-,22+,23-,24-,26+,27+,28-/m0/s1
InChIKeySQCUZGZMTBZFAU-QIBDZGQISA-N
Species of MetaboliteComponentSourceComments
Ganoderma (ncbitaxon:5314) - PubMed (31494344)
ChEBI Ontology
Outgoing Relation(s)
(22E,24R)-ergosta-7,22-dien-3beta,5alpha-diol-6,5-olide (CHEBI:227864) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(1S,2R,5S,7S,12R,15R,16R)-15-[(E,2R,5R)-5,6-dimethylhept-3-en-2-yl]-5,7-dihydroxy-2,16-dimethyl-8-oxatetracyclo[9.7.0.02,7.012,16]octadec-10-en-9-one