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(Q105248564)
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English
2,3-dihydroxypropyl octadec-9-enoate
group of stereoisomers with the chemical formula C₂₁H₄₀O₄
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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
356.29265976
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₄₀O₄
0 references
canonical SMILES
O=C(OCC(O)CO)CCCCCCCC=CCCCCCCCC
0 references
found in taxon
Bauhinia
1 reference
stated in
A novel 6-butyl-3-hydroxyflavanone from heartwood of Bauhinia purpurea
Identifiers
InChI
InChI=1S/C21H40O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(24)25-19-20(23)18-22/h9-10,20,22-23H,2-8,11-19H2,1H3
0 references
InChIKey
RZRNAYUHWVFMIP-UHFFFAOYSA-N
0 references
PubChem CID
33022
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
180958
mapping relation type
exact match
1 reference
stated in
ChEBI release 2022-06-13
SureChEMBL ID
SCHEMBL15604
1 reference
based on heuristic
inferred from InChIKey
UniChem compound ID
26105676
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0254854
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
RZRNAYUHWVFMIP-UHFFFAOYSA-N
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