ChemSpider 2D Image | (5E)-tetradecenoyl-L-carnitine | C21H39NO4

(5E)-tetradecenoyl-L-carnitine

  • Molecular FormulaC21H39NO4
  • Average mass369.539 Da
  • Monoisotopic mass369.287903 Da
  • ChemSpider ID31047229

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3R)-3-[(5E)-5-Tetradecenoyloxy]-4-(trimethylammonio)butanoat [German] [ACD/IUPAC Name]
(3R)-3-[(5E)-5-Tetradecenoyloxy]-4-(trimethylammonio)butanoate [ACD/IUPAC Name]
(3R)-3-[(5E)-5-Tetradecenoyloxy]-4-(triméthylammonio)butanoate [French] [ACD/IUPAC Name]
(5E)-tetradecenoyl-L-carnitine
1-Propanaminium, 3-carboxy-N,N,N-trimethyl-2-[[(5E)-1-oxo-5-tetradecen-1-yl]oxy]-, inner salt, (2R)- [ACD/Index Name]
835598-21-5 [RN]
(3R)-3-[(5E)-TETRADEC-5-ENOYLOXY]-4-(TRIMETHYLAMMONIO)BUTANOATE
(3R)-3-[(5E)-TETRADEC-5-ENOYLOXY]-4-(TRIMETHYLAZANIUMYL)BUTANOATE
(3R)-3-{[(5E)-tetradec-5-enoyl]oxy}-4-(trimethylazaniumyl)butanoate
(5E)-tetradec-5-enoyl-L-carnitine
More...
  • Miscellaneous

    • Chemical Class:

      An <element>O</element>-tetradecenoyl-<stereo>L</stereo>-carnitine obtained by formal condensation of the carboxy group of (5<stereo>E</stereo>)-tetradecenoic acid with the hydroxy group of <stereo>L< /stereo>-carnitine. ChEBI CHEBI:131957
      An O-tetradecenoyl-L-carnitine obtained by formal condensation of the carboxy group of (5E)-tetradecenoic acid with the hydroxy group of <stereo>L<; /stereo>-carnitine. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:131957
      An O-tetradecenoyl-L-carnitine obtained by formal condensation of the carboxy group of (5E)-tetradecenoic acid with the hydroxy group of L-carnitine. ChEBI CHEBI:131957

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 15.90
ACD/KOC (pH 5.5): 372.79
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 15.99
ACD/KOC (pH 7.4): 374.90
Polar Surface Area: 66 Å2
Polarizability:
Surface Tension:
Molar Volume:

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