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155915-46-1 | L-Serine, N-(1-oxohexadecyl)-O-phosphono-
CAS No: 155915-46-1 Catalog No: AG001OC3 MDL No:
Product Description
Catalog Number:
AG001OC3
Chemical Name:
L-Serine, N-(1-oxohexadecyl)-O-phosphono-
CAS Number:
155915-46-1
Molecular Formula:
C19H38NO7P
Molecular Weight:
423.4813
IUPAC Name:
(2S)-2-(hexadecanoylamino)-3-phosphonooxypropanoic acid
InChI:
InChI=1S/C19H38NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18(21)20-17(19(22)23)16-27-28(24,25)26/h17H,2-16H2,1H3,(H,20,21)(H,22,23)(H2,24,25,26)/t17-/m0/s1
InChI Key:
HSMUPNYJCMYKJH-KRWDZBQOSA-N
SMILES:
CCCCCCCCCCCCCCCC(=O)N[C@H](C(=O)O)COP(=O)(O)O
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
423.239g/mol
Formal Charge:
0
Heavy Atom Count:
28
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
423.487g/mol
Monoisotopic Mass:
423.239g/mol
Rotatable Bond Count:
19
Topological Polar Surface Area:
133A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.7
Literature
| Title | Journal |
|---|---|
| Synthesis, structure-activity relationships, and biological evaluation of fatty alcohol phosphates as lysophosphatidic acid receptor ligands, activators of PPARgamma, and inhibitors of autotaxin. | Journal of medicinal chemistry 20050728 |
| Lysophosphatidic acid-independent platelet activation by low-density lipoprotein. | FEBS letters 20010406 |
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