1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine

• CAS: 59403-53-1
• Catalog Number: ACM59403531
• Category: Other Products
• Molecular Weight: 762.1
• Molecular Formula: C42H84NO8P
• Synonyms: 18:0-16:0 PC
• IUPAC Name: [(2R)-2-Hexadecanoyloxy-3-octadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
• Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
• InChI: InChI=1S/C42H84NO8P/c1-6-8-10-12-14-16-18-20-21-23-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-22-19-17-15-13-11-9-7-2/h40H,6-39H2,1-5H3/t40-/m1/s1
• InChI Key: BYSIMVBIJVBVPA-RRHRGVEJSA-N
• Complexity: 857
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 1
• Exact Mass: 761.59345564
• Heavy Atom Count: 52
• Hydrogen Bond Acceptor Count: 8
• Hydrogen Bond Donor Count: 0
• Isomeric SMILES: CCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC
• Monoisotopic Mass: 761.59345564
• Physical State: Powder
• Rotatable Bond Count: 42
• Storage Conditions: -20 °C
• Topological Polar Surface Area: 111 Ų

Custom Q&A

What is the chemical structure of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine?

The chemical structure of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine can be found at the provided reference link.

What is the IUPAC name of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine?

The IUPAC name of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine is [(2R)-2-hexadecanoyloxy-3-octadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate.

What is the molecular formula of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine?

The molecular formula of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine is C42H84NO8P.

What is the computed properties complexity of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine?

The computed properties complexity of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine is 857.

What is the topological polar surface area of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine?

The topological polar surface area of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine is 111.

What is the exact mass of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine?

The exact mass of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine is 761.59345564.

What is the canonical SMILES representation of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine?

The canonical SMILES representation of 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine is CCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCC.

How many rotatable bonds does 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine have?

1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine has 42 rotatable bonds.

What are some synonyms for 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine?

Some synonyms for 1-Stearoyl-2-palmitoyl-sn-glycero-3-phosphocholine include PC(18:0/16:0), Phosphatidylcholine(18:0/16:0), and 1-octadecanoyl-2-hexadecanoyl-sn-glycero-3-phosphocholine.