3-Carboxy-N,N,N-Trimethyl-2-(Octanoyloxy)Propan-1-Aminium (Q27094710)

octanoyl-d-carnitine (English)

octanoyl-L-carnitine (uncharged form)

4 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₁₅H₃₀NO₄⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

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

1 reference

octanoyl-d-carnitine (English)

4 October 2016

isomeric SMILES

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

1 reference

octanoyl-d-carnitine (English)

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/p+1/t13-/m0/s1

4 October 2016

Identifiers

InChI

1 reference

octanoyl-d-carnitine (English)

CXTATJFJDMJMIY-ZDUSSCGKSA-O

4 October 2016

InChIKey

1 reference

octanoyl-d-carnitine (English)

4 October 2016

1 reference

(2S)-3-Carboxy-N,N,N-trimethyl-2-(octanoyloxy)-1-propanaminium (English)

4 October 2016

1 reference

octanoyl-d-carnitine (English)

4 October 2016

1 reference

1 reference

3-Carboxy-N,N,N-Trimethyl-2-(Octanoyloxy)Propan-1-Aminium (English)