Cas no 79512-78-0 (3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (7R)-)

3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (7R)- structure
79512-78-0 structure
Product Name:3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (7R)-
CAS No:79512-78-0
MF:C26H52NO8P
MW:537.666749954224
CID:555328
PubChem ID:16759367
Update Time:2025-04-19

3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (7R)- Chemical and Physical Properties

Names and Identifiers

    • 3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (7R)-
    • 3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-,innersalt,4-oxide,(7R]
    • NS00074264
    • BML3-F04
    • 3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (7R)-
    • CHEBI:75219
    • (2R)-2-acetoxy-3-(hexadecanoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
    • SCHEMBL434281
    • PC(16:0/2:0)
    • NCGC00161385-01
    • HMS1989E13
    • HMS1791E13
    • (2R)-2-acetoxy-3-(palmitoyloxy)propyl 2-(trimethylazaniumyl)ethyl phosphate
    • CHEMBL1335151
    • HMS1361E13
    • LMGP01010612
    • DTXSID701105288
    • 1-Palmitoyl-2-acetyl-sn-glycero-3-phosphocholine
    • 79512-78-0
    • NCGC00161385-02
    • HMS3402E13
    • 1-hexadecanoyl-2-acetyl-sn-glycero-3-phosphocholine
    • 1-Palmitoyl-2-acetyl-sn-glycero-3-phosphorylcholine
    • 1-O-Palmitoyl-2-O-acetyl-sn-glyceryl-3-phosphorylcholine
    • NCGC00161385-03
    • 16:0-02:0 PC, 1-palmitoyl-2-acetyl-sn-glycero-3-phosphocholine, chloroform
    • 1-palmitoyl-2-acetyl-sn-phosphatidylcholine
    • Q27145169
    • 1-acyl-PAF
    • [(2R)-2-acetyloxy-3-hexadecanoyloxypropyl] 2-(trimethylazaniumyl)ethyl phosphate
    • 3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-,inner salt,4-oxide,(7R)-
    • 3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (R)-
    • Inchi: 1S/C26H52NO8P/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-19-26(29)32-22-25(35-24(2)28)23-34-36(30,31)33-21-20-27(3,4)5/h25H,6-23H2,1-5H3/t25-/m1/s1
    • InChI Key: XPAXRSJGGFVTFM-RUZDIDTESA-N
    • SMILES: P(=O)([O-])(OC[C@@H](COC(CCCCCCCCCCCCCCC)=O)OC(C)=O)OCC[N+](C)(C)C

Computed Properties

  • Exact Mass: 537.343
  • Monoisotopic Mass: 537.343
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 36
  • Rotatable Bond Count: 26
  • Complexity: 615
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 1
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 111A^2
  • XLogP3: 6.1

Experimental Properties

  • Color/Form: 10?mg/mL (880622C-25mg)
    5?mg/mL (880622C-5mg)

3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (7R)- Security Information

  • Hazardous Material transportation number:UN 1888 6.1 / PGIII
  • Storage Condition:?20°C

3,5,9-Trioxa-4-phosphapentacosan-1-aminium,7-(acetyloxy)-4-hydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, (7R)- Pricemore >>

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XI GE MA AO DE LI QI ( SHANG HAI ) MAO YI Co., Ltd.
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