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English
1-hydroxy-3-(octacosanoyloxy)propan-2-yl octacosanoate
group of stereoisomers with the chemical formula C₅₉H₁₁₆O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
biogenic acyclic ester
1 reference
inferred from
biogenic acyclic ester
mass
904.8822768120001
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₅₉H₁₁₆O₅
0 references
canonical SMILES
O=C(OCC(OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCCCC)CO)CCCCCCCCCCCCCCCCCCCCCCCCCCC
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Identifiers
InChI
InChI=1S/C59H116O5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-58(61)63-56-57(55-60)64-59(62)54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h57,60H,3-56H2,1-2H3
0 references
InChIKey
YFICNBBIYKTBLK-UHFFFAOYSA-N
0 references
CAS Registry Number
52363-45-8
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
19421331
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YFICNBBIYKTBLK-UHFFFAOYSA-N
UniChem compound ID
24910896
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID601198569
1 reference
matched by identifier from
InChIKey
InChIKey
YFICNBBIYKTBLK-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0031010
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YFICNBBIYKTBLK-UHFFFAOYSA-N
KNApSAcK ID
C00057422
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
YFICNBBIYKTBLK-UHFFFAOYSA-N
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