Structural formula of 1,2-Dipalmitoyl-D62-3-sn-Glycerophosphatidylcholine

1,2-Dipalmitoyl-D62-3-sn-Glycerophosphatidylcholine

Product number: 71-3716
CAS number: 29287-66-9
Synonyms: Choline, hydroxide, dihydrogen phosphate, inner salt, ester with 1,2-dipalmitin-(palmitoyl-d31)2, Palmitin-(palmitoyl-d31)2, 1,2-di-, dihydrogen phosphate, monoester with choline hydroxide, inner salt, Dipalmitoylphosphatidylcholine-2H62

Identifiers

CAS Index Name: 3,5,9-Trioxa-4-phosphapentacosan-11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,22,22,23,23,24,24,25,25,25-d31-1-aminium, 4-hydroxy-N,N,N-trimethyl-10-oxo-7-[(1-oxohexadecyl-2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,16-d31)oxy]-, inner salt, 4-oxide
Molecular formula: C40H18D62NO8P
Molecular weight: 796.42
Smiles: O=C(OCC(OC(=O)CCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C)CCCCCCCCCCCCCCC
Isomeric Smiles: C(OC(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C([2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])=O)(COP(OCC[N+](C)(C)C)(=O)[O-])COC(C(C(C(C(C(C(C(C(C(C(C(C(C(C(C([2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])([2H])[2H])=O
InChI: InChI=1S/C40H80NO8P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-39(42)46-36-38(37-48-50(44,45)47-35-34-41(3,4)5)49-40(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h38H,6-37H2,1-5H3/i1D3,2D3,6D2,7D2,8D2,9D2,10D2,11D2,12D2,13D2,14D2,15D2,16D2,17D2,18D2,19D2,20D2,21D2,22D2,23D2,24D2,25D2,26D2,27D2,28D2,29D2,30D2,31D2,32D2,33D2
InChIKey: InChIKey=KILNVBDSWZSGLL-YRBUOSFMSA-N

Product information

Purity: >98%
Storage: Freezer
Supplied as: Neat or in solution
Physical state: Solid
Documentation: Certificate of Analysis
MSDS: Download

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71-3716-71,2-Dipalmitoyl-D62-3-sn-Glycerophosphatidylcholine - 25 mg293.00
71-3716-91,2-Dipalmitoyl-D62-3-sn-Glycerophosphatidylcholine - 100 mg795.00