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

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

Catalog Number ACM70897277-1
CAS 70897-27-7
Synonyms PC(17:0/17:0)
IUPAC Name [(2R)-2,3-Di(heptadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight 762.1
Molecular Formula C42H84NO8P
Canonical SMILES CCCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCC
InChI InChI=1S/C42H84NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-41(44)48-38-40(39-50-52(46,47)49-37-36-43(3,4)5)51-42(45)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h40H,6-39H2,1-5H3/t40-/m1/s1
InChI Key RTWAYAIMWLNAJW-RRHRGVEJSA-N
Purity 99%+
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 CCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCCCCC
Monoisotopic Mass 761.59345564
Physical State Powder
Rotatable Bond Count 42
Storage Conditions -20 °C
Topological Polar Surface Area 111 Ų
Q&A

What is the IUPAC name of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

The IUPAC name of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine is [(2R)-2,3-di(heptadecanoyloxy)propyl] 2-(trimethylazaniumyl)ethyl phosphate.

What is the molecular formula of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

The molecular formula of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine is C42H84NO8P.

What is the molecular weight of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

The molecular weight of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine is 762.1g/mol.

What is the exact mass of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

The exact mass of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine is 761.59345564.

How many heavy atoms are present in 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

There are 52 heavy atoms in 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine.

How many rotatable bonds are present in 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

There are 42 rotatable bonds in 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine.

How many hydrogen bond acceptors are present in 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

There are 8 hydrogen bond acceptors in 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine.

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

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

What is the InChI key of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

The InChI key of 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine is RTWAYAIMWLNAJW-RRHRGVEJSA-N.

What are some of the synonyms provided for 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine?

Some of the synonyms provided for 1,2-Diheptadecanoyl-sn-glycero-3-phosphocholine are 1,2-Diheptadecanoyl-sn-glycero-3-phosphorylcholine, PC(17:0/17:0), DHDPC, and 17:0 PC.

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