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CHEBI:214370 - Acaciicolide B

ChEBI IDCHEBI:214370
ChEBI NameAcaciicolide B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H22O5
Net Charge0
Average Mass282.336
Monoisotopic Mass282.14672
SMILESCC1(C)C=CC(=O)[C@]2(C)OC3(O)C[C@]12CCC3(O)CO
InChIInChI=1S/C15H22O5/c1-11(2)5-4-10(17)12(3)13(11)6-7-14(18,9-16)15(19,8-13)20-12/h4-5,16,18-19H,6-9H2,1-3H3/t12-,13+,14?,15?/m0/s1
InChIKeyWGPNDQAUYHDXQA-ZUJMUWTESA-N
Species of MetaboliteComponentSourceComments
Pseudolagarobasidium acaciicola (ncbitaxon:386453) - PubMed (26701647)
ChEBI Ontology
Outgoing Relation(s)
Acaciicolide B (CHEBI:214370) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
(1R,6R)-8,9-dihydroxy-9-(hydroxymethyl)-2,2,6-trimethyl-7-oxatricyclo[6.3.1.01,6]dodec-3-en-5-one
Manual XrefsDatabases
78442122ChemSpider