PHAEOPHYTIN, alpha beta
methyl 16-ethenyl-11-ethyl-12-(hydroxymethylidene)-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-(3,7,11,15-tetramethylhexadec-2-enoxy)propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5(26),6,8,10,13(25),14,16,18(24),19-decaene-3-carboxylate
Also Known As: PHAEOPHYTIN, alpha beta
| Molecular Formula | C55H72N4O6 |
|---|---|
| Molecular Weight | 884.54517 g/mol |
| LogP | 12.13 |
| Topological Polar Surface Area | 139.01 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 20 |
| Exact Mass | 884.54517 |
| Heavy Atoms | 65 |
| Complexity | 2349.7 |
Chemical Identifiers
| CAS Number | 3147-18-0 |
|---|---|
| SMILES | CCC1=C2C=C3C(=C4C(=O)C(C(=C5C(C(C(=CC6=NC(=CC(=N2)C1=CO)C(=C6C)C=C)N5)C)CCC(=O)OCC=C(C)CCCC(C)CCCC(C)CCCC(C)C)C4=N3)C(=O)OC)C |
Product Overview
PHAEOPHYTIN, alpha beta (CAS 3147-18-0), with molecular formula C55H72N4O6 and molecular weight 884.54517 g/mol. IUPAC: methyl 16-ethenyl-11-ethyl-12-(hydroxymethylidene)-17,21,26-trimethyl-4-oxo-22-[3-oxo-3-(3,7,11,15-tetramethylhexadec-2-enoxy)propyl]-7,23,24,25-tetrazahexacyclo[18.2.1.15,8.110,13.115,18.02,6]hexacosa-1,5(26),6,8,10,13(25),14,16,18(24),19-decaene-3-carboxylate.
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