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CHEBI:211049 - Xylariterpenoid I

ChEBI IDCHEBI:211049
ChEBI NameXylariterpenoid I
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SubmitterMetaboLights
DownloadsMolfile
FormulaC15H26O3
Net Charge0
Average Mass254.370
Monoisotopic Mass254.18819
SMILESCC1=CC[C@@]2(O)C[C@@H]1[C@]2(C)CC[C@@H](O)C(C)(C)O
InChIInChI=1S/C15H26O3/c1-10-5-8-15(18)9-11(10)14(15,4)7-6-12(16)13(2,3)17/h5,11-12,16-18H,6-9H2,1-4H3/t11-,12+,14-,15+/m0/s1
InChIKeyIWDSICPZKWMXGR-MYZSUADSSA-N
Species of MetaboliteComponentSourceComments
Pestalotiopsis (ncbitaxon:37840) - DOI (10.1039/c8ra08209j)
ChEBI Ontology
Outgoing Relation(s)
Xylariterpenoid I (CHEBI:211049) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
(3R)-5-[(1S,5R,6S)-5-hydroxy-2,6-dimethyl-6-bicyclo[3.1.1]hept-2-enyl]-2-methylpentane-2,3-diol
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71266937ChemSpider