Hexanoylcarnitine

CAS Registry Number®

6418-78-6
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CAS Name

Hexanoylcarnitine

Molecular Formula

C13H25NO4

Cite this Page

Hexanoylcarnitine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6418-78-6 (retrieved 2024-09-07) (CAS RN: 6418-78-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H25NO4/c1-5-6-7-8-13(17)18-11(9-12(15)16)10-14(2,3)4/h11H,5-10H2,1-4H3

InChIKey

InChIKey=VVPRQWTYSNDTEA-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxohexyl)oxy]-, inner salt
  • Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, hydroxide, inner salt, hexanoate
  • (3-Carboxy-2-hydroxypropyl)trimethylammonium hydroxide, inner salt, hexanoate
  • Hexanoic acid, ester with (3-carboxy-2-hydroxypropyl)trimethylammonium hydroxide, inner salt
  • Hexanoylcarnitine

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Deleted or Replaced CAS Registry Numbers

68960-69-0