Vaccine Lab / Alfa Chemistry
1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine

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1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine

Catalog Number ACM91742119
CAS 91742-11-9
Synonyms 24:0 PC
IUPAC Name [(2R)-2,3-Di(tetracosanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight 958.5
Molecular Formula C56H112NO8P
Canonical SMILES CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCC
InChI InChI=1S/C56H112NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38-40-42-44-46-48-55(58)62-52-54(53-64-66(60,61)63-51-50-57(3,4)5)65-56(59)49-47-45-43-41-39-37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h54H,6-53H2,1-5H3/t54-/m1/s1
InChI Key XOAMGMFHUNHBEM-AXAMJWTMSA-N
Purity 99%+
Complexity 1080
Covalently-Bonded Unit Count 1
Defined Atom Stereocenter Count 1
Exact Mass 957.81255653
Heavy Atom Count 66
Hydrogen Bond Acceptor Count 8
Hydrogen Bond Donor Count 0
Isomeric SMILES CCCCCCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCC
Monoisotopic Mass 957.81255653
Physical State Liquid
Rotatable Bond Count 56
Storage Conditions -20 °C
Topological Polar Surface Area 111 Ų
Knowledge & Learning Case Study Q&A

What is the Computed Properties Heavy Atom Count of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine?

The Computed Properties Heavy Atom Count of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine is 66.

What is the CAS number of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine?

The CAS number of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine is 91742-11-9.

How many Hydrogen Bond Acceptor Count does 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine have?

1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine has 8 Hydrogen Bond Acceptor Counts.

What is the Computed Properties Rotatable Bond Count of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine?

The Computed Properties Rotatable Bond Count of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine is 56.

What is the Canonical SMILES of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine?

The Canonical SMILES of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine is CCCCCCCCCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCC.

What is the IUPAC Name of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine?

The IUPAC Name of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine is [(2R)-2,3-di(tetracosanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate.

What is the Molecular Formula of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine?

The Molecular Formula of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine is C56H112NO8P.

What is the Monoisotopic Mass of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine?

The Monoisotopic Mass of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine is 957.81255653.

What is a Depositor-Supplied Synonym of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine?

A Depositor-Supplied Synonym of 1,2-Ditetracosanoyl-sn-glycero-3-phosphocholine is PC(24:0/24:0).

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