Solanesyl phosphate
[(1E,5E,9E,13E,17E,21E,25E,29E)-1-azaniumyl-1-hydroxy-2,6,10,14,18,22,26,30,34-nonamethylpentatriaconta-1,5,9,13,17,21,25,29,33-nonaen-3-yl]azanium;bis(dihydrogen phosphate)
Also Known As: Solanesyl phosphate|[(1E,5E,9E,13E,17E,21E,25E,29E)-1-azaniumyl-1-hydroxy-2,6,10,14,18,22,26,30,34-nonamethylpentatriaconta-1,5,9,13,17,21,25,29,33-nonaen-3-yl]azanium;dihydrogen phosphate|[(1E,5E,9E,13E,17E,21E,25E,29E)-1-azaniumyl-1-hydroxy-2,6,10,14,18,22,26,30,34-nonamethylpentatriaconta-1,5,9,13,17,21,25,29,33-nonaen-3-yl]azanium; dihydrogen phosphate|1,5,9,13,17,21,25,29,33-Pentatriacontanonaen-1-ol, 2,6,10,14,18,22,26,30,34-nonamethyl-, dihydrogen phosphate, diammonium salt
| Molecular Formula | C44H80N2O9P2 |
|---|---|
| Molecular Weight | 842.53394 g/mol |
| LogP | 8.9489 |
| Topological Polar Surface Area | 236.69 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 24 |
| Exact Mass | 842.53394 |
| Monoisotopic Mass | 842.53394 |
| Heavy Atoms | 57 |
| Complexity | 1476.5615 |
Chemical Identifiers
| CAS Number | 98229-45-9 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC/C(=C/CC(/C(=C(\[NH3+])/O)/C)[NH3+])/C)/C)/C)/C)/C)/C)/C)C.OP(=O)(O)[O-].OP(=O)(O)[O-] |
Product Overview
Solanesyl phosphate (CAS 98229-45-9), with molecular formula C44H80N2O9P2 and molecular weight 842.53394 g/mol. IUPAC: [(1E,5E,9E,13E,17E,21E,25E,29E)-1-azaniumyl-1-hydroxy-2,6,10,14,18,22,26,30,34-nonamethylpentatriaconta-1,5,9,13,17,21,25,29,33-nonaen-3-yl]azanium;bis(dihydrogen phosphate).
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