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Also known as: 4537-77-3, Dppg, 1,2-dipalmitoylphosphatidylglycerol, Va9u6br3sb, Chebi:60724, [3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate

Molecular Formula

C₃₈H₇₅O₁₀P

Molecular Weight

723.0 g/mol

InChI Key

BIABMEZBCHDPBV-UHFFFAOYSA-N

FDA UNII

VA9U6BR3SB

1 2D Structure

Dipalmitoylphosphatidylglycerol

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

[3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxypropyl] hexadecanoate

2.1.2 InChI

InChI=1S/C38H75O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-37(41)45-33-36(34-47-49(43,44)46-32-35(40)31-39)48-38(42)30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,39-40H,3-34H2,1-2H3,(H,43,44)

2.1.3 InChI Key

BIABMEZBCHDPBV-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCC(CO)O)OC(=O)CCCCCCCCCCCCCCC

2.2 Other Identifiers

2.2.1 UNII

VA9U6BR3SB

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 1,2-dipalmitoyl-sn-glycero-3-phosphoglycerol

2. 1,2-dipalmitoylphosphatidylglycerol

3. Dppg

2.3.2 Depositor-Supplied Synonyms

1. 4537-77-3

2. Dppg

3. 1,2-dipalmitoylphosphatidylglycerol

4. Va9u6br3sb

5. Chebi:60724

6. [3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxy-2-hexadecanoyloxypropyl] Hexadecanoate

7. 3-(((2,3-dihydroxypropoxy)(hydroxy)phosphoryl)oxy)propane-1,2-diyl Dipalmitate

8. 3-{[(2,3-dihydroxypropoxy)(hydroxy)phosphoryl]oxy}-2-(hexadecanoyloxy)propyl Hexadecanoate

9. 1,2-dipalmitoyl-phosphatidyl-glycerole

10. Unii-va9u6br3sb

11. Dipalmitoyl Phosphatidylglycerol

12. Starbld0008282

13. C16:0 Phosphatidylglycerol

14. Chembl2286758

15. Schembl13587396

16. Dl-dipalmitoylphosphatidylglycerol

17. Dtxsid70963375

18. C16:0 Pg

19. Db02043

20. Dipalmitoylphosphatidylglycerol, Dl-

21. Q27888734

22. Hexadecanoic Acid, 1,1'-(1-((((2,3-dihydroxypropoxy)hydroxyphosphinyl)oxy)methyl)-1,2-ethanediyl)ester

23. Hexadecanoic Acid, 1-((((2,3-dihydroxypropoxy)hydroxyphosphinyl)oxy)methyl)-1,2-ethanediyl Ester

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₃₈H₇₅O₁₀P
Molecular Weight	723.0 g/mol
XLogP3	12.2
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	10
Rotatable Bond Count	40
Exact Mass	722.50978558 g/mol
Monoisotopic Mass	722.50978558 g/mol
Topological Polar Surface Area	149 Å²
Heavy Atom Count	49
Formal Charge	0
Complexity	797
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1