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CHEBI:207986 - Truncateol P

ChEBI IDCHEBI:207986
ChEBI NameTruncateol P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H20O4
Net Charge0
Average Mass276.332
Monoisotopic Mass276.13616
SMILESC=C(C)C#CC1=C[C@@H]2O[C@@H](C(C)(C)O)C[C@]23O[C@@H]3[C@H]1O
InChIInChI=1S/C16H20O4/c1-9(2)5-6-10-7-11-16(14(20-16)13(10)17)8-12(19-11)15(3,4)18/h7,11-14,17-18H,1,8H2,2-4H3/t11-,12+,13-,14+,16-/m0/s1
InChIKeyRYJXVFAYRJLCCJ-QKDZRIPBSA-N
Species of MetaboliteComponentSourceComments
Truncatella angustata (ncbitaxon:152316) - PubMed (30077121)
ChEBI Ontology
Outgoing Relation(s)
Truncateol P (CHEBI:207986) is a oxolanes (CHEBI:26912)
IUPAC Name 
(1S,3R,4S,7S,9R)-9-(2-hydroxypropan-2-yl)-5-(3-methylbut-3-en-1-ynyl)-2,8-dioxatricyclo[5.3.0.01,3]dec-5-en-4-ol
Manual XrefsDatabases
71048841ChemSpider