1,2-Dipalmitoyl-SN-glycero-3-phospho-L-serine (monosodium salt)

Catalog Number	ACM145849327-1
CAS	145849-32-7
Structure
Synonyms	16:0 PS
IUPAC Name	Sodium;(2S)-2-azaniumyl-3-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-oxidophosphoryl]oxypropanoate
Molecular Weight	757.9
Molecular Formula	C38H73NNaO10P
Canonical SMILES	CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC(C(=O)[O-])[NH3+])OC(=O)CCCCCCCCCCCCCCC.[Na+]
InChI	InChI=1S/C38H74NO10P.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-36(40)46-31-34(32-47-50(44,45)48-33-35(39)38(42)43)49-37(41)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h34-35H,3-33,39H2,1-2H3,(H,42,43)(H,44,45);/q;+1/p-1/t34-,35+;/m1./s1
InChI Key	GTLXLANTBWYXGW-CEGNZRHUSA-M
Purity	98%+
Complexity	861
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	2
Exact Mass	757.48697881
Heavy Atom Count	51
Hydrogen Bond Acceptor Count	10
Hydrogen Bond Donor Count	1
Isomeric SMILES	CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](C(=O)[O-])[NH3+])OC(=O)CCCCCCCCCCCCCCC.[Na+]
Monoisotopic Mass	757.48697881
Physical State	Solid
Rotatable Bond Count	39
Storage Conditions	-20 °C
Topological Polar Surface Area	179 Ų

Knowledge & Learning Case Study Q&A

What is the molecular formula of 1,2-Dipalmitoyl-SN-glycero-3-phospho-L-serine (monosodium salt)?

The molecular formula is C38H73NNaO10P.

What is the exact mass of 1,2-Dipalmitoyl-SN-glycero-3-phospho-L-serine (monosodium salt)?

The exact mass is 757.48697881.

What is the IUPAC name of 1,2-Dipalmitoyl-SN-glycero-3-phospho-L-serine (monosodium salt)?

The IUPAC name is sodium;(2S)-2-azaniumyl-3-[[(2R)-2,3-di(hexadecanoyloxy)propoxy]-oxidophosphoryl]oxypropanoate.

What is the CAS number of 1,2-Dipalmitoyl-SN-glycero-3-phospho-L-serine (monosodium salt)?

The CAS number is 145849-32-7.

How many hydrogen bond acceptors are there in the molecule?

There are 10 hydrogen bond acceptors.

Is 1,2-Dipalmitoyl-SN-glycero-3-phospho-L-serine (monosodium salt) a covalently-bonded unit?

Yes, it is a covalently-bonded unit.

What is the canonical SMILES of 1,2-Dipalmitoyl-SN-glycero-3-phospho-L-serine (monosodium salt)?

The canonical SMILES is CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)([O-])OCC(C(=O)[O-])[NH3+])OC(=O)CCCCCCCCCCCCCCCC.[Na+].

How many heavy atoms are there in the molecule?

There are 51 heavy atoms.

What is the molecular weight of 1,2-Dipalmitoyl-SN-glycero-3-phospho-L-serine (monosodium salt)?

The molecular weight is 757.9g/mol.

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