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(Q82825642)
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English
(10R)-2-Hydroxynonadecan-10-yl naphthalene-2-carboxylate
group of stereoisomers with the chemical formula C₃₀H₄₆O₃
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
454.34469533199996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₄₆O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCCCCCCCCC(CCCCCCCC(C)O)OC(=O)c1ccc2ccccc2c1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCCCCCCCC[C@H](CCCCCCCC(C)O)OC(=O)c1ccc2ccccc2c1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C30H46O3/c1-3-4-5-6-7-10-13-20-29(21-14-11-8-9-12-17-25(2)31)33-30(32)28-23-22-26-18-15-16-19-27(26)24-28/h15-16,18-19,22-25,29,31H,3-14,17,20-21H2,1-2H3/t25?,29-/m1/s1
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InChIKey
VRCODIHVOHIJFM-SNSSHHSLSA-N
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CAS Registry Number
825623-08-3
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PubChem CID
71418191
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
65516976
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80837513
0 references
DSSTOX compound identifier
DTXCID00788255
0 references
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