DESMOSINE
2-amino-6-[4-(4-amino-4-carboxybutyl)-3,5-bis(3-amino-3-carboxypropyl)pyridin-1-ium-1-yl]hexanoic acid
Also Known As: DESMOSINE, Desmosine-d4, 2-amino-6-[4-(4-amino-4-carboxybutyl)-3,5-bis(3-amino-3-carboxypropyl)pyridin-1-ium-1-yl]hexanoic acid, norleucine, 6-[4-(4-amino-4-carboxybutyl)-3,5-bis(3-amino-3-carboxypropyl)pyridinio]-, 2-amino-6-[3,5-bis(3-amino-4-hydroxy-4-oxobutyl)-4-(4-amino-5-hydroxy-5-oxopentyl)pyridin-1-ium-1-yl]hexanoic acid, 2-AMINO-6-[4-(4-AMINO-4-CARBOXY-BUTYL)-3,5-BIS(3-AMINO-3-CARBOXY-PROPYL)PYRIDIN-1-YL]HEXANOIC ACID, 4-(4-Amino-4-carboxybutyl)-1-(5-amino-5-carboxypentyl)-3,5-bis(3-amino-3-carboxypropyl)pyridinium
| Molecular Formula | C24H40N5O8+ |
|---|---|
| Molecular Weight | 526.28766 g/mol |
| LogP | -1.02 |
| Topological Polar Surface Area | 257.16 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 19 |
| Exact Mass | 526.28766 |
| Heavy Atoms | 37 |
| Complexity | 896 |
Chemical Identifiers
| CAS Number | 11003-57-9 |
|---|---|
| SMILES | C1=C(C(=C(C=[N+]1CCCCC(C(=O)O)N)CCC(C(=O)O)N)CCCC(C(=O)O)N)CCC(C(=O)O)N |
Product Overview
DESMOSINE (CAS 11003-57-9), with molecular formula C24H40N5O8+ and molecular weight 526.28766 g/mol. IUPAC: 2-amino-6-[4-(4-amino-4-carboxybutyl)-3,5-bis(3-amino-3-carboxypropyl)pyridin-1-ium-1-yl]hexanoic acid.
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