Adenosyl cobyrinate diamide
2-(6-aminopurin-9-yl)-5-methanidyloxolane-3,4-diol;3-[2,7-bis(2-amino-2-oxoethyl)-3,13,17-tris(2-carboxyethyl)-18-(carboxymethyl)-1,2,5,7,12,12,15,17-octamethyl-8,13,18,19-tetrahydro-3H-corrin-24-id-8-yl]propanoic acid;cobalt(3+)
Also Known As: Adenosyl cobyrinate diamide
| Molecular Formula | C55H73CoN11O15+ |
|---|---|
| Molecular Weight | 1186.4619 g/mol |
| LogP | 4.36419 |
| Topological Polar Surface Area | 443.17 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 19 |
| Exact Mass | 1186.4619 |
| Monoisotopic Mass | 1186.4619 |
| Heavy Atoms | 82 |
| Complexity | 3150.8506 |
Chemical Identifiers
| CAS Number | 6917-85-7 |
|---|---|
| SMILES | CC1=C2C(C(C([N-]2)C3(C(C(C(=N3)C(=C4C(C(C(=N4)C=C5C(C(C1=N5)CCC(=O)O)(C)C)CCC(=O)O)(C)CC(=O)N)C)CCC(=O)O)(C)CC(=O)N)C)CC(=O)O)(C)CCC(=O)O.[CH2-]C1C(C(C(O1)N2C=NC3=C(N=CN=C32)N)O)O.[Co+3] |
Product Overview
Adenosyl cobyrinate diamide (CAS 6917-85-7), with molecular formula C55H73CoN11O15+ and molecular weight 1186.4619 g/mol. IUPAC: 2-(6-aminopurin-9-yl)-5-methanidyloxolane-3,4-diol;3-[2,7-bis(2-amino-2-oxoethyl)-3,13,17-tris(2-carboxyethyl)-18-(carboxymethyl)-1,2,5,7,12,12,15,17-octamethyl-8,13,18,19-tetrahydro-3H-corrin-24-id-8-yl]propanoic acid;cobalt(3+).
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