1-Pentadecanoyl-sn-glycero-3-phosphocholine

Catalog Number	ACM108273898
CAS	108273-89-8
Synonyms	15:0 LYSO PC
IUPAC Name	[(2R)-2-Hydroxy-3-pentadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
Molecular Weight	481.6
Molecular Formula	C23H48NO7P
Canonical SMILES	CCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O
InChI	InChI=1S/C23H48NO7P/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23(26)29-20-22(25)21-31-32(27,28)30-19-18-24(2,3)4/h22,25H,5-21H2,1-4H3/t22-/m1/s1
InChI Key	RJZVWDTYEWCUAR-JOCHJYFZSA-N
Purity	99%+
Complexity	503
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Exact Mass	481.31683987
Heavy Atom Count	32
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	1
Isomeric SMILES	CCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[N+](C)(C)C)O
Monoisotopic Mass	481.31683987
Physical State	Powder
Rotatable Bond Count	23
Storage Conditions	-20 °C
Topological Polar Surface Area	105 Ų

Knowledge & Learning Case Study Q&A

What is the InChIKey for 1-Pentadecanoyl-sn-glycero-3-phosphocholine?

The InChIKey for 1-Pentadecanoyl-sn-glycero-3-phosphocholine is RJZVWDTYEWCUAR-JOCHJYFZSA-N.

What is the CAS number for 1-Pentadecanoyl-sn-glycero-3-phosphocholine?

The CAS number for 1-Pentadecanoyl-sn-glycero-3-phosphocholine is 108273-89-8.

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

The molecular weight of 1-Pentadecanoyl-sn-glycero-3-phosphocholine is 481.6g/mol.

How many hydrogen bond acceptors are present in 1-Pentadecanoyl-sn-glycero-3-phosphocholine?

There are 7 hydrogen bond acceptors present in 1-Pentadecanoyl-sn-glycero-3-phosphocholine.

What is the Canonical SMILES notation for 1-Pentadecanoyl-sn-glycero-3-phosphocholine?

The Canonical SMILES notation for 1-Pentadecanoyl-sn-glycero-3-phosphocholine is CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[N+](C)(C)C)O.

How many rotatable bonds are present in 1-Pentadecanoyl-sn-glycero-3-phosphocholine?

There are 23 rotatable bonds present in 1-Pentadecanoyl-sn-glycero-3-phosphocholine.

What is the IUPAC Name of 1-Pentadecanoyl-sn-glycero-3-phosphocholine?

The IUPAC Name of 1-Pentadecanoyl-sn-glycero-3-phosphocholine is [(2R)-2-hydroxy-3-pentadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate.

How many heavy atoms are present in 1-Pentadecanoyl-sn-glycero-3-phosphocholine?

There are 32 heavy atoms present in 1-Pentadecanoyl-sn-glycero-3-phosphocholine.

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

The exact mass of 1-Pentadecanoyl-sn-glycero-3-phosphocholine is 481.31683987.

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