1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine

Catalog Number	ACM123060402-1
CAS	123060-40-2
Synonyms	14:0 LYSO PE
IUPAC Name	2-Azaniumylethyl [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate
Molecular Weight	425.5
Molecular Formula	C19H40NO7P
Canonical SMILES	CCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[NH3+])O
InChI	InChI=1S/C19H40NO7P/c1-2-3-4-5-6-7-8-9-10-11-12-13-19(22)25-16-18(21)17-27-28(23,24)26-15-14-20/h18,21H,2-17,20H2,1H3,(H,23,24)/t18-/m1/s1
InChI Key	RPXHXZNGZBHSMJ-GOSISDBHSA-N
Purity	99%+
Complexity	415
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Exact Mass	425.25423961
Heavy Atom Count	28
Hydrogen Bond Acceptor Count	7
Hydrogen Bond Donor Count	2
Isomeric SMILES	CCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])O
Monoisotopic Mass	425.25423961
Physical State	Powder
Rotatable Bond Count	21
Storage Conditions	-20 °C
Topological Polar Surface Area	133 Ų

Knowledge & Learning Q&A

What is the molecular formula of 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

The molecular formula is C19H40NO7P.

What is the exact mass of 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

The exact mass is 425.25423961 g/mol.

How many heavy atoms are present in 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

There are 28 heavy atoms.

What is the CAS number of 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

The CAS number is 123060-40-2.

What are some synonyms for 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

Some synonyms include LPE(14:0/0:0), 1-myristoylglycerophosphoethanolamine, and BP-29603.

How many hydrogen bond acceptors are in 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

There are 7 hydrogen bond acceptors.

What is the canonical SMILES representation of 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

The canonical SMILES is CCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC[NH3+])O.

How many rotatable bonds are in 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

There are 21 rotatable bonds.

What is the IUPAC name for 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

The IUPAC name is 2-azaniumylethyl [(2R)-2-hydroxy-3-tetradecanoyloxypropyl] phosphate.

What is the InChIKey for 1-Myristoyl-2-hydroxy-sn-glycero-3-phosphoethanolamine?

The InChIKey is RPXHXZNGZBHSMJ-GOSISDBHSA-N.

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