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CHEBI:198240 - Stearyl-glutinopallal

ChEBI IDCHEBI:198240
ChEBI NameStearyl-glutinopallal
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC34H54O6
Net Charge0
Average Mass558.800
Monoisotopic Mass558.39204
SMILESCCCCCCCCCCCCCCCCCC(=O)OC1OC[C@@]23OC2[C@H]2C(=C(C)C)C[C@H]2[C@]2(C(=O)OC)CC132
InChIInChI=1S/C34H54O6/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-27(35)39-31-33-22-32(33,30(36)37-4)26-21-25(24(2)3)28(26)29-34(33,40-29)23-38-31/h26,28-29,31H,5-23H2,1-4H3/t26-,28+,29?,31?,32+,33?,34-/m1/s1
InChIKeyXQOYYEYKUFVOEK-DPGLPURQSA-N
Species of MetaboliteComponentSourceComments
Lactarius glutinopallens (ncbitaxon:1032839) - DOI (10.1016/0031-9422(88)80636-8)
ChEBI Ontology
Outgoing Relation(s)
Stearyl-glutinopallal (CHEBI:198240) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
methyl (1R,4R,7R,8R)-11-octadecanoyloxy-5-propan-2-ylidene-2,12-dioxapentacyclo[8.3.0.01,3.04,7.08,10]tridecane-8-carboxylate
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78443783ChemSpider