Isobutyrylcarnitine

CAS Registry Number®

25518-49-4
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CAS Name

Isobutyrylcarnitine

Molecular Formula

C11H21NO4

Cite this Page

Isobutyrylcarnitine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=25518-49-4 (retrieved 2024-09-06) (CAS RN: 25518-49-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H21NO4/c1-8(2)11(15)16-9(6-10(13)14)7-12(3,4)5/h8-9H,6-7H2,1-5H3/t9-/m1/s1

InChIKey

InChIKey=LRCNOZRCYBNMEP-SECBINFHSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-(2-methyl-1-oxopropoxy)-, inner salt, (2R)-
  • Ammonium, (3-carboxy-2-hydroxypropyl)trimethyl-, hydroxide, inner salt, isobutyrate, L-
  • 1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-(2-methyl-1-oxopropoxy)-, inner salt, (R)-
  • Isobutyric acid, ester with (3-carboxy-2-hydroxypropyl)trimethylammonium hydroxide inner salt, L-
  • Isobutyryl-L-(-)-carnitine

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