1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexadecyl)oxy]-, inner salt, (2S)-

CAS Registry Number®

2364-66-1
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CAS Name

1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexadecyl)oxy]-, inner salt, (2S)-

Molecular Formula

C23H45NO4

Cite this Page

1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexadecyl)oxy]-, inner salt, (2S)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2364-66-1 (retrieved 2024-08-07) (CAS RN: 2364-66-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C23H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(27)28-21(19-22(25)26)20-24(2,3)4/h21H,5-20H2,1-4H3/t21-/m0/s1

InChIKey

InChIKey=XOMRRQXKHMYMOC-NRFANRHFSA-N

SMILES

[C@@H](OC(CCCCCCCCCCCCCCC)=O)(C[N+](C)(C)C)CC([O-])=O

Canonical SMILES

O=C([O-])CC(OC(=O)CCCCCCCCCCCCCCC)C[N+](C)(C)C

Other Names for this Substance

  • 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexadecyl)oxy]-, inner salt, (2S)-
  • Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, hydroxide, inner salt, palmitate, D-
  • 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexadecyl)oxy]-, inner salt, (S)-
  • Palmitic acid, ester with (3-carboxy-2-hydroxypropyl)trimethylammonium hydroxide inner salt, D-
  • (+)-Palmitoylcarnitine

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Deleted or Replaced CAS Registry Numbers

4469-07-2, 13962-02-2