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CHEBI:217659 - Xylarilongipin B

ChEBI IDCHEBI:217659
ChEBI NameXylarilongipin B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H28O3
Net Charge0
Average Mass316.441
Monoisotopic Mass316.20384
SMILESCC12CCC3(CC1)C(=C[C@H]1OC(=O)[C@@]4(C)C[C@H](O)C[C@@]3(C)[C@@H]14)C2
InChIInChI=1S/C20H28O3/c1-17-4-6-20(7-5-17)12(9-17)8-14-15-18(2,16(22)23-14)10-13(21)11-19(15,20)3/h8,13-15,21H,4-7,9-11H2,1-3H3/t13-,14+,15-,17?,18-,19-,20?/m0/s1
InChIKeyQFMZSOQSIRWWFN-GHGBXWOXSA-N
Species of MetaboliteComponentSourceComments
Xylaria (ncbitaxon:37991) - PubMed (32195526)
ChEBI Ontology
Outgoing Relation(s)
Xylarilongipin B (CHEBI:217659) is a terpene lactone (CHEBI:37668)
IUPAC Name 
(2S,4R,6S,9R,18R)-4-hydroxy-2,6,13-trimethyl-8-oxapentacyclo[11.2.2.12,6.01,11.09,18]octadec-10-en-7-one