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CONTACT US| Catalog Number | ACM35418587-1 |
| CAS | 35418-58-7 |
| Structure |  |
| Synonyms | 1-Palmitoyl-2-arachidoyllecithin |
| IUPAC Name | [(2R)-2-Hexadecanoyloxy-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate |
| Molecular Weight | 782.1 |
| Molecular Formula | C44H80NO8P |
| Canonical SMILES | CCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCC=CCC=CCC=CCC=CCCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChI | InChI=1S/C44H80NO8P/c1-6-8-10-12-14-16-18-20-21-22-23-25-26-28-30-32-34-36-43(46)50-40-42(41-52-54(48,49)51-39-38-45(3,4)5)53-44(47)37-35-33-31-29-27-24-19-17-15-13-11-9-7-2/h14,16,20-21,23,25,28,30,42H,6-13,15,17-19,22,24,26-27,29,31-41H2,1-5H3/b16-14-,21-20-,25-23-,30-28-/t42-/m1/s1 |
| InChI Key | PUDHBQQGURLBGJ-IVFHWKNFSA-N |
| Purity | 99%+ |
| Complexity | 1060 |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 1 |
| Exact Mass | 781.56215551 |
| Heavy Atom Count | 54 |
| Hydrogen Bond Acceptor Count | 8 |
| Hydrogen Bond Donor Count | 0 |
| Isomeric SMILES | CCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCC[N+](C)(C)C |
| Monoisotopic Mass | 781.56215551 |
| Physical State | Liquid |
| Rotatable Bond Count | 40 |
| Storage Conditions | -20 °C |
| Topological Polar Surface Area | 111 Ų |
What is the molecular formula and molecular weight of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
The molecular formula of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine is C44H80NO8P, and the molecular weight is 782.1g/mol
What is the Canonical SMILES representation of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
The Canonical SMILES representation of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine is CCCCCCCCCCCCCCCCC(=O)OC(COC(=O)CCCC=CCC=CCC=CCC=CCCCCC)COP(=O)([O-])OCC[N+](C)(C)C
What is the CAS number for 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
The CAS number for 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine is 35418-58-7
How many heavy atoms are present in the molecular structure of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
There are 54 heavy atoms present in the molecular structure of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine
What is the XLogP3 value for 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
The XLogP3 value for 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine is 12.6
What is the IUPAC name of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
The IUPAC name of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine is [(2R)-2-hexadecanoyloxy-3-[(5Z,8Z,11Z,14Z)-icosa-5,8,11,14-tetraenoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
What is the Monoisotopic Mass of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
The Monoisotopic Mass of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine is 781.56215551
How many rotatable bonds are present in the molecular structure of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
There are 40 rotatable bonds present in the molecular structure of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine
What is the topological polar surface area of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine?
The topological polar surface area of 1-Arachidonoyl-2-palmitoyl-sn-glycero-3-phosphocholine is 111
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