CHEBI:207527 - Aureonitol B

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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 Aureonitol B
ChEBI ID CHEBI:207527
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C13H20O4
Net Charge 0
Average Mass 240.299
Monoisotopic Mass 240.13616
InChI InChI=1S/C13H20O4/c1-2-3-4-5-10-9-16-13(12(10)15)7-6-11(8-14)17-13/h3-5,11-12,14-15H,2,6-9H2,1H3/b4-3+,10-5-/t11-,12+,13-/m1/s1
InChIKey XARYPOJIZIDWQJ-NMSLPPHZSA-N
SMILES O1[C@]2(OC\C(\[C@@H]2O)=C\C=C\CC)CC[C@@H]1CO
Metabolite of Species Details
Chaetomium globosum (NCBI:txid38033) See: PubMed
ChEBI Ontology
Outgoing Aureonitol B (CHEBI:207527) is a ketal (CHEBI:59777)
IUPAC Name
(2R,5R,8Z,9S)-2-(hydroxymethyl)-8-[(E)-pent-2-enylidene]-1,6-dioxaspiro[4.4]nonan-9-ol