1-Palmitoyl-sn-glycero-3-phosphocholine

Catalog Number	ACM97281384
CAS	97281-38-4 / 17364-16-8
Structure
Synonyms	L-α-Lysophosphatidylcholine (soy)
IUPAC Name	[(2R)-3-hexadecanoyloxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight	495.6
Molecular Formula	C24H50NO7P
Canonical SMILES	CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O
InChI	InChI=1S/C24H50NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24(27)30-21-23(26)22-32-33(28,29)31-20-19-25(2,3)4/h23,26H,5-22H2,1-4H3/t23-/m1/s1
InChI Key	ASWBNKHCZGQVJV-HSZRJFAPSA-N
Purity	99%+
Complexity	517
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Exact Mass	495.33248993
Heavy Atom Count	33
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isomeric SMILES	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O
Monoisotopic Mass	495.33248993
Physical State	Powder
Rotatable Bond Count	24
Storage Conditions	-20 °C
Topological Polar Surface Area	105 Ų

Knowledge & Learning Case Study Q&A

What is the IUPAC name of 1-Palmitoyl-sn-glycero-3-phosphocholine?

The IUPAC name of 1-Palmitoyl-sn-glycero-3-phosphocholine is [(2R)-3-hexadecanoyloxy-2-[(9Z,12Z)-octadeca-9,12-dienoyl]oxypropyl] 2-(trimethylazaniumyl)ethyl phosphate.

What is the molecular formula of 1-Palmitoyl-sn-glycero-3-phosphocholine?

The molecular formula of 1-Palmitoyl-sn-glycero-3-phosphocholine is C42H80NO8P.

What is the molecular weight of 1-Palmitoyl-sn-glycero-3-phosphocholine?

The molecular weight of 1-Palmitoyl-sn-glycero-3-phosphocholine is 758.1g/mol.

What is the exact mass of 1-Palmitoyl-sn-glycero-3-phosphocholine?

The exact mass of 1-Palmitoyl-sn-glycero-3-phosphocholine is 757.56215551.

What is the Canonical SMILES of 1-Palmitoyl-sn-glycero-3-phosphocholine?

The Canonical SMILES of 1-Palmitoyl-sn-glycero-3-phosphocholine is CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCC=CCC=CCCCCC.

What is the CAS number of 1-Palmitoyl-sn-glycero-3-phosphocholine?

The CAS numbers of 1-Palmitoyl-sn-glycero-3-phosphocholine are 8002-43-5 and 17708-90-6.

How many hydrogen bond acceptors does 1-Palmitoyl-sn-glycero-3-phosphocholine have?

1-Palmitoyl-sn-glycero-3-phosphocholine has 8 hydrogen bond acceptors.

How many rotatable bonds does 1-Palmitoyl-sn-glycero-3-phosphocholine have?

1-Palmitoyl-sn-glycero-3-phosphocholine has 40 rotatable bonds.

What is the XLogP3 value of 1-Palmitoyl-sn-glycero-3-phosphocholine?

The XLogP3 value of 1-Palmitoyl-sn-glycero-3-phosphocholine is 12.9.

What are some of the other names or synonyms for 1-Palmitoyl-sn-glycero-3-phosphocholine?

Some other names or synonyms for 1-Palmitoyl-sn-glycero-3-phosphocholine include LECITHIN, Soybean phospholipid, and Heart PC, L-alpha-phosphatidylcholine.

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1-Palmitoyl-sn-glycero-3-phosphocholine (97281-38-4 / 17364-16-8)

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