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CHEBI:226202 - Pseudapene C

ChEBI IDCHEBI:226202
ChEBI NamePseudapene C
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O3
Net Charge0
Average Mass250.338
Monoisotopic Mass250.15689
SMILESC=C1CC[C@]2(O)C[C@](C)(C(=O)[C@H](O)C=C(C)C)[C@H]12
InChIInChI=1S/C15H22O3/c1-9(2)7-11(16)13(17)14(4)8-15(18)6-5-10(3)12(14)15/h7,11-12,16,18H,3,5-6,8H2,1-2,4H3/t11-,12+,14+,15+/m1/s1
InChIKeySRCGDEZWCNEOKY-DHMWGJHJSA-N
Species of MetaboliteComponentSourceComments
Pseudallescheria (ncbitaxon:5596) - DOI (10.1016/j.tetlet.2019.150953)
ChEBI Ontology
Outgoing Relation(s)
Pseudapene C (CHEBI:226202) is a secondary α-hydroxy ketone (CHEBI:2468)
IUPAC Name 
(2R)-2-hydroxy-1-[(1S,5S,6S)-1-hydroxy-6-methyl-4-methylidene-6-bicyclo[3.2.0]heptanyl]-4-methylpent-3-en-1-one
Manual XrefsDatabases
77089222ChemSpider