N-Palmitoylsphingomyelin

CAS Registry Number®

6254-89-3

CAS Name

N-Palmitoylsphingomyelin

Molecular Formula

C39H79N2O6P

Cite this Page

N-Palmitoylsphingomyelin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6254-89-3 (retrieved 2024-11-22) (CAS RN: 6254-89-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C39H79N2O6P/c1-6-8-10-12-14-16-18-20-22-24-26-28-30-32-38(42)37(36-47-48(44,45)46-35-34-41(3,4)5)40-39(43)33-31-29-27-25-23-21-19-17-15-13-11-9-7-2/h30,32,37-38,42H,6-29,31,33-36H2,1-5H3,(H-,40,43,44,45)/b32-30+/t37-,38+/m0/s1

InChIKey

InChIKey=RWKUXQNLWDTSLO-GWQJGLRPSA-N

SMILES

[C@H](NC(CCCCCCCCCCCCCCC)=O)(COP(OCC[N+](C)(C)C)(=O)[O-])[C@@H](/C=C/CCCCCCCCCCCCC)O

Canonical SMILES

O=C(NC(COP(=O)([O-])OCC[N+](C)(C)C)C(O)C=CCCCCCCCCCCCCC)CCCCCCCCCCCCCCC

Other Names for this Substance

  • 3,5-Dioxa-8-aza-4-phosphatetracosan-1-aminium, 4-hydroxy-7-[(1R,2E)-1-hydroxy-2-hexadecen-1-yl]-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, (7S)-
  • Choline, dihydrogen phosphate, inner salt, 1-ester with N-[2-hydroxy-1-(hydroxymethyl)-3-heptadecenyl]hexadecanamide, D-erythro-trans-
  • 3,5-Dioxa-8-aza-4-phosphatetracosan-1-aminium, 4-hydroxy-7-(1-hydroxy-2-hexadecenyl)-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, [R-[R*,S*-(E)]]-
  • 3,5-Dioxa-8-aza-4-phosphatetracosan-1-aminium, 4-hydroxy-7-[(1R,2E)-1-hydroxy-2-hexadecenyl]-N,N,N-trimethyl-9-oxo-, inner salt, 4-oxide, (7S)-
  • Hexadecanamide, N-[2-hydroxy-1-(hydroxymethyl)-3-heptadecenyl]-, 1-(dihydrogen phosphate), monoester with choline, inner salt, D-erythro-trans-

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Deleted or Replaced CAS Registry Numbers

952324-61-7

CAS INSIGHTSTM
Targeted protein degrader structure, illustration