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CHEBI:216461 - Opaliferin

ChEBI IDCHEBI:216461
ChEBI NameOpaliferin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H28O6
Net Charge0
Average Mass352.427
Monoisotopic Mass352.18859
SMILESC[C@@H]1CC/C(=C2\C(=O)C[C@@H]3O[C@@]4(C[C@H]23)C[C@H](O)[C@H](CC[C@@H](C)O)O4)O1
InChIInChI=1S/C19H28O6/c1-10(20)3-5-15-14(22)9-19(24-15)8-12-17(25-19)7-13(21)18(12)16-6-4-11(2)23-16/h10-12,14-15,17,20,22H,3-9H2,1-2H3/b18-16+/t10-,11-,12+,14+,15+,17+,19+/m1/s1
InChIKeyJACPLNLRQCNGQJ-FACFEIAPSA-N
Species of MetaboliteComponentSourceComments
Cordycepsspecies NBRC 106954 (ncbitaxon:1472367) - PubMed (25171745)
ChEBI Ontology
Outgoing Relation(s)
Opaliferin (CHEBI:216461) is a ketal (CHEBI:59777)
IUPAC Name 
(2R,3aR,4E,4'S,5'S,6aS)-4'-hydroxy-5'-[(3R)-3-hydroxybutyl]-4-[(5R)-5-methyloxolan-2-ylidene]spiro[3,3a,6,6a-tetrahydrocyclopenta[b]uran-2,2'-oxolane]-5-one
Manual XrefsDatabases
34452037ChemSpider