CHEBI:227068 - Limacellone

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Limacellone
ChEBI ID CHEBI:227068
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H20O5
Net Charge 0
Average Mass 280.320
Monoisotopic Mass 280.13107
InChI InChI=1S/C15H20O5/c1-8-6-14-10(5-9(8)16)13(4)12(2,3)15(17,20-14)7-11(18-13)19-14/h5,8,11,17H,6-7H2,1-4H3/t8-,11-,13-,14-,15?/m1/s1
InChIKey JJKCMWNJRYLLKG-PTKJDVLHSA-N
SMILES O=C1C=C2[C@]3(OC4(O)C[C@@H](O3)O[C@]2(C4(C)C)C)C[C@H]1C
Metabolite of Species Details
Zhuliangomyces illinitus (NCBI:txid181928) See: PubMed
ChEBI Ontology
Outgoing Limacellone (CHEBI:227068) is a ketal (CHEBI:59777)
IUPAC Name
(1R,3R,7S,9R)-11-hydroxy-3,7,14,14-tetramethyl-8,12,13-trioxatetracyclo[7.3.1.17,11.01,6]tetradec-5-en-4-one