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81517-87-5 | 6-[(1E,3Z,6Z,9Z)-pentadeca-1,3,6,9-tetraenyl]oxan-2-one
CAS No: 81517-87-5 Catalog No: AG005K7W MDL No:MFCD00079350
Product Description
Catalog Number:
AG005K7W
Chemical Name:
6-[(1E,3Z,6Z,9Z)-pentadeca-1,3,6,9-tetraenyl]oxan-2-one
CAS Number:
81517-87-5
Molecular Formula:
C20H30O2
Molecular Weight:
302.4510
MDL Number:
MFCD00079350
IUPAC Name:
6-[(1E,3Z,6Z,9Z)-pentadeca-1,3,6,9-tetraenyl]oxan-2-one
InChI:
InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-17-15-18-20(21)22-19/h6-7,9-10,12-14,16,19H,2-5,8,11,15,17-18H2,1H3/b7-6-,10-9-,13-12-,16-14+
InChI Key:
QZMAEYDIHWEEAF-XTDASVJISA-N
SMILES:
CCCCC/C=C\C/C=C\C/C=C\C=C\C1CCCC(=O)O1
Properties
Complexity:
402
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
4
Exact Mass:
302.225g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
302.458g/mol
Monoisotopic Mass:
302.225g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
6
Literature
| Title | Journal |
|---|---|
| Mouse serum paraoxonase-1 lactonase activity is specific for medium-chain length fatty acid lactones. | Biochimica et biophysica acta 20110101 |
| Human paraoxonases (PON1, PON2, and PON3) are lactonases with overlapping and distinct substrate specificities. | Journal of lipid research 20050601 |
| Lactonase and lactonizing activities of human serum paraoxonase (PON1) and rabbit serum PON3. | Biochemical pharmacology 20030915 |
| Toxicity of human monocytic THP-1 cells and microglia toward SH-SY5Y neuroblastoma cells is reduced by inhibitors of 5-lipoxygenase and its activating protein FLAP. | Journal of leukocyte biology 20030301 |
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