3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 4-hydroxy-N,N,N-trimethyl-7-(1-oxopropoxy)-, inner salt, 4-oxide

CAS Registry Number®

79849-07-3

CAS Name

3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 4-hydroxy-N,N,N-trimethyl-7-(1-oxopropoxy)-, inner salt, 4-oxide

Molecular Formula

C27H56NO7P

Cite this Page

3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 4-hydroxy-N,N,N-trimethyl-7-(1-oxopropoxy)-, inner salt, 4-oxide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79849-07-3 (retrieved 2024-11-22) (CAS RN: 79849-07-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H56NO7P/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-22-32-24-26(35-27(29)7-2)25-34-36(30,31)33-23-21-28(3,4)5/h26H,6-25H2,1-5H3

InChIKey

InChIKey=IMFQQPWSHMFNRT-UHFFFAOYSA-N

SMILES

C(COP(OCC[N+](C)(C)C)(=O)[O-])(COCCCCCCCCCCCCCCCC)OC(CC)=O

Canonical SMILES

O=C(OC(COCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[N+](C)(C)C)CC

Other Names for this Substance

  • 3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 4-hydroxy-N,N,N-trimethyl-7-(1-oxopropoxy)-, inner salt, 4-oxide
  • 3,5,9-Trioxa-4-phosphapentacosan-1-aminium, 4-hydroxy-N,N,N-trimethyl-7-(1-oxopropoxy)-, inner salt, 4-oxide, (±)-
  • 1-O-Hexadecyl-2-O-propionyl-rac-glyceryl-3-phosphorylcholine

Deleted or Replaced CAS Registry Numbers

120374-86-9

CAS INSIGHTSTM
Hourglass and a clock