1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine

Catalog Number	ACM69441094
CAS	69441-09-4
Synonyms	16:0-14:0 PC
IUPAC Name	[(2R)-3-Hexadecanoyloxy-2-tetradecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight	706
Molecular Formula	C38H76NO8P
Canonical SMILES	CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCC
InChI	InChI=1S/C38H76NO8P/c1-6-8-10-12-14-16-18-19-21-22-24-26-28-30-37(40)44-34-36(35-46-48(42,43)45-33-32-39(3,4)5)47-38(41)31-29-27-25-23-20-17-15-13-11-9-7-2/h36H,6-35H2,1-5H3/t36-/m1/s1
InChI Key	UIXXHROAQSBBOV-PSXMRANNSA-N
Purity	99%+
Complexity	796
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Exact Mass	705.53085538
Heavy Atom Count	48
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	0
Isomeric SMILES	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCC
Monoisotopic Mass	705.53085538
Physical State	Powder
Rotatable Bond Count	38
Storage Conditions	-20 °C
Topological Polar Surface Area	111 Ų

Knowledge & Learning Case Study Q&A

What is the canonical SMILES of 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine?

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)OC(=O)CCCCCCCCCCCCC

What is the CAS number of 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine?

69441-09-4

How many hydrogen bond acceptors does 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine have?

8

What is the XLogP3 value of 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine?

12.4

What is the molecular formula of 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine?

C38H76NO8P

Is 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine a complex molecule? If so, what is its complexity value?

Yes, complexity value is 796

What is the IUPAC name of 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine?

[(2R)-3-hexadecanoyloxy-2-tetradecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

What is the exact mass of 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine?

705.53085538 g/mol

How many rotatable bonds does 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine have?

38

What is the UNII (Unique Ingredient Identifier) of 1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine?

C5XLU3T5RL

Our products and services are for research use only and cannot be used for any clinical purposes.

Online Inquiry

1-Palmitoyl-2-myristoyl-sn-glycero-3-phosphocholine (69441-09-4)

Send A Message