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(Q115970797)
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English
[2-(15-Methylhexadecanoyloxy)-3-pentadecanoyloxypropyl] octadec-9-enoate
group of stereoisomers with the chemical formula C₅₃H₁₀₀O₆
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
832.75199092
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₅₃H₁₀₀O₆
0 references
canonical SMILES
O=C(OCC(OC(=O)CCCCCCCCCCCCCC(C)C)COC(=O)CCCCCCCCCCCCCC)CCCCCCCC=CCCCCCCCC
0 references
found in taxon
Caenorhabditis elegans
1 reference
stated in
A study of Caenorhabditis elegans DAF-2 mutants by metabolomics and differential correlation networks.
Identifiers
InChI
InChI=1S/C53H100O6/c1-5-7-9-11-13-15-17-19-20-21-25-29-33-37-41-45-52(55)58-48-50(47-57-51(54)44-40-36-32-28-24-18-16-14-12-10-8-6-2)59-53(56)46-42-38-34-30-26-22-23-27-31-35-39-43-49(3)4/h19-20,49-50H,5-18,21-48H2,1-4H3
0 references
InChIKey
OUHLKPMNPWFJMR-UHFFFAOYSA-N
0 references
PubChem CID
162930489
2 references
stated in
PubChem
retrieved
3 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OUHLKPMNPWFJMR-UHFFFAOYSA-N
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