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DESMOSINE STANDARD

CAS No.:
10019-68-8
Catalog Number:
AG009R49
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG009R49
Chemical Name:
DESMOSINE STANDARD
CAS Number:
10019-68-8
MDL Number:
MFCD12910449
IUPAC Name:
2-amino-6-[4-(4-amino-4-carboxybutyl)-3,5-bis(3-amino-3-carboxypropyl)pyridin-1-ium-1-yl]hexanoic acid;chloride
InChI:
InChI=1S/C24H39N5O8.ClH/c25-17(21(30)31)5-1-2-11-29-12-14(7-9-19(27)23(34)35)16(4-3-6-18(26)22(32)33)15(13-29)8-10-20(28)24(36)37;/h12-13,17-20H,1-11,25-28H2,(H3-,30,31,32,33,34,35,36,37);1H
InChI Key:
FUPMLZCXPJSGPV-UHFFFAOYSA-N
Properties
Complexity:
721  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
561.257g/mol
Formal Charge:
0
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
13  
Hydrogen Bond Donor Count:
8  
Isotope Atom Count:
0
Molecular Weight:
562.061g/mol
Monoisotopic Mass:
561.257g/mol
Rotatable Bond Count:
19  
Topological Polar Surface Area:
257A^2
Undefined Atom Stereocenter Count:
4  
Undefined Bond Stereocenter Count:
0
Properties