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1321573-23-2 | Acetoxy-Lysylpyridinoline
CAS No: 1321573-23-2 Catalog No: AG01E0VX MDL No:
Product Description
Catalog Number:
AG01E0VX
Chemical Name:
Acetoxy-Lysylpyridinoline
CAS Number:
1321573-23-2
IUPAC Name:
(2S)-3-[1-[(2R,5S)-2-acetyloxy-5-amino-5-carboxypentyl]-3-[(3S)-3-amino-3-carboxypropyl]-5-hydroxypyridin-1-ium-4-yl]-2-aminopropanoate
InChI:
InChI=1S/C20H30N4O9/c1-10(25)33-12(3-5-15(22)19(29)30)8-24-7-11(2-4-14(21)18(27)28)13(17(26)9-24)6-16(23)20(31)32/h7,9,12,14-16H,2-6,8,21-23H2,1H3,(H3-,26,27,28,29,30,31,32)/t12-,14+,15+,16+/m1/s1
InChI Key:
FTKWIGZSPBRDLK-OEAJRASXSA-N
Properties
Complexity:
687
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
4
Defined Bond Stereocenter Count:
0
Exact Mass:
470.201g/mol
Formal Charge:
0
Heavy Atom Count:
33
Hydrogen Bond Acceptor Count:
12
Hydrogen Bond Donor Count:
6
Isotope Atom Count:
0
Molecular Weight:
470.479g/mol
Monoisotopic Mass:
470.201g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
243A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-8
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