CHEBI:181224 - OctaDecanoyl-L-carnitine D3

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ChEBI Name OctaDecanoyl-L-carnitine D3
ChEBI ID CHEBI:181224
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C25H47D3NO4
Net Charge +1
Average Mass 431.696
Monoisotopic Mass 431.39227
InChI InChI=1S/C25H49NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-25(29)30-23(21-24(27)28)22-26(2,3)4/h23H,5-22H2,1-4H3/p+1/i2D3
InChIKey FNPHNLNTJNMAEE-BMSJAHLVSA-O
SMILES O(C(C[N+](C([2H])([2H])[2H])(C)C)CC(O)=O)C(=O)CCCCCCCCCCCCCCCCC
ChEBI Ontology
Outgoing OctaDecanoyl-L-carnitine D3 (CHEBI:181224) is a O-acylcarnitine (CHEBI:17387)
IUPAC Name
(3-carboxy-2-octadecanoyloxypropyl)-dimethyl-(trideuteriomethyl)azanium