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CHEBI:208002 - Truncateol S

ChEBI IDCHEBI:208002
ChEBI NameTruncateol S
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H22O4
Net Charge0
Average Mass278.348
Monoisotopic Mass278.15181
SMILESC=C(C)C=C=C1C[C@@H]2O[C@@H](C(C)(C)O)C[C@]23O[C@@H]3[C@H]1O
InChIInChI=1S/C16H22O4/c1-9(2)5-6-10-7-11-16(14(20-16)13(10)17)8-12(19-11)15(3,4)18/h5,11-14,17-18H,1,7-8H2,2-4H3/t6?,11-,12+,13-,14+,16-/m0/s1
InChIKeyLLRPKSSOCRSQLN-MDJUDDASSA-N
Species of MetaboliteComponentSourceComments
Truncatella angustata (ncbitaxon:152316) - PubMed (30077121)
ChEBI Ontology
Outgoing Relation(s)
Truncateol S (CHEBI:208002) is a oxacycle (CHEBI:38104)
Manual XrefsDatabases
35516902ChemSpider