Octanoylcarnitine

CAS Registry Number®

3671-77-0
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CAS Name

Octanoylcarnitine

Molecular Formula

C15H29NO4

Cite this Page

Octanoylcarnitine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3671-77-0 (retrieved 2024-09-07) (CAS RN: 3671-77-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H29NO4/c1-5-6-7-8-9-10-15(19)20-13(11-14(17)18)12-16(2,3)4/h13H,5-12H2,1-4H3

InChIKey

InChIKey=CXTATJFJDMJMIY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[(1-oxooctyl)oxy]-, inner salt
  • Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, hydroxide, inner salt, octanoate
  • (3-Carboxy-2-hydroxypropyl)trimethylammonium hydroxide, inner salt, octanoate
  • Octanoic acid, ester with (3-carboxy-2-hydroxypropyl)trimethylammonium hydroxide, inner salt
  • Octanoylcarnitine

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Deleted or Replaced CAS Registry Numbers

4469-11-8, 76581-93-6