Porfimer Sodium
3-[13-[1-[1-[8,12-bis(2-carboxyethyl)-17-(1-hydroxyethyl)-3,7,13,18-tetramethyl-21,24-dihydroporphyrin-2-yl]ethoxy]ethyl]-18-(2-carboxyethyl)-8-(1-hydroxyethyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoic acid
Also Known As: Porfimer Sodium|DIHEMATOPORPHYRIN ETHER|625J2HS54G|bis-1-(8-(1-hydroxyethyl)deuteroporphyrin-3-yl)ethyl ether|21H,23H-Porphine-2,18-dipropanoic acid, 7-[1-[1-[8,12-bis(2-carboxyethyl)-17-(1-hydroxyethyl)-3,7,13,18-tetramethyl-21H,23H-porphin-2-yl]ethoxy]ethyl]-12-(1-hydroxyethyl)-3,8,13,17-tetramethyl-
| Molecular Formula | C68H74N8O11 |
|---|---|
| Molecular Weight | 1178.5477 g/mol |
| LogP | 14.3 |
| Topological Polar Surface Area | 313.61 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 18 |
| Exact Mass | 1178.5477 |
| Heavy Atoms | 87 |
| Complexity | 4423.2 |
Chemical Identifiers
| CAS Number | 97067-70-4 |
|---|---|
| SMILES | CC1=C(C2=CC3=NC(=CC4=NC(=CC5=C(C(=C(N5)C=C1N2)C(C)OC(C)C6=C(C7=CC8=C(C(=C(N8)C=C9C(=C(C(=N9)C=C1C(=C(C(=N1)C=C6N7)C)CCC(=O)O)CCC(=O)O)C)C)C(C)O)C)C)C(=C4CCC(=O)O)C)C(=C3C)CCC(=O)O)C(C)O |
Product Overview
Porfimer Sodium (CAS 97067-70-4), with molecular formula C68H74N8O11 and molecular weight 1178.5477 g/mol. IUPAC: 3-[13-[1-[1-[8,12-bis(2-carboxyethyl)-17-(1-hydroxyethyl)-3,7,13,18-tetramethyl-21,24-dihydroporphyrin-2-yl]ethoxy]ethyl]-18-(2-carboxyethyl)-8-(1-hydroxyethyl)-3,7,12,17-tetramethyl-22,23-dihydroporphyrin-2-yl]propanoic acid.
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