CHEBI:202721 - Clitocybulol E

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
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 Clitocybulol E
ChEBI ID CHEBI:202721
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C15H22O5
Net Charge 0
Average Mass 282.336
Monoisotopic Mass 282.14672
InChI InChI=1S/C15H22O5/c1-8-6-20-15(19)12(17)9(2)10-4-13(3,7-16)5-11(10)14(8,15)18/h9,12,16-19H,1,4-7H2,2-3H3/t9-,12+,13-,14-,15-/m1/s1
InChIKey FYWBFDKJGCOKPJ-ZRPPUJLASA-N
SMILES O1[C@@]2(O)[C@](O)(C3=C(C[C@](C3)(CO)C)[C@H]([C@@H]2O)C)C(C1)=C
Metabolite of Species Details
Pleurotus cystidiosus (NCBI:txid28992) See: PubMed
ChEBI Ontology
Outgoing Clitocybulol E (CHEBI:202721) is a oxolanes (CHEBI:26912)
IUPAC Name
(3aR,4S,5R,7R,8bS)-7-(hydroxymethyl)-5,7-dimethyl-1-methylidene-4,5,6,8-tetrahydrocyclopenta[e][1]benzouran-3a,4,8b-triol
Manual Xref Database
78436908 ChemSpider
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