A medium-chain and phenyl-substituted acyl CoA
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3-Phenylpropanoyl-Coenzyme A (sodium salt)

Item No. 39998

Product Insert (PDF)Safety Data Sheet (SDS) (PDF)
Technical Information
Formal Name
S-benzenepropanoate coenzyme A, sodium salt
Synonyms
  • 3-Phenylpropanoyl-CoA
  • 3-Phenylpropionyl-CoA
  • 3-Phenylpropionyl-Coenzyme A
Molecular Formula
C30H44N7O17P3S • XNa
Formula Weight
899.7
Purity
≥90%
Formulation (Request formulation change)
A solid
Solubility(Learn about Variance in Solubility)
Water: Soluble
SMILES
O[C@H]([C@@H]1O[P](O)(O)=O)[C@@H](O[C@@H]1CO[P](O[P](OCC(C)(C)[C@@H](O)C(NCCC(NCCSC(CCC2=CC=CC=C2)=O)=O)=O)(O)=O)(O)=O)N3C4=NC=NC(N)=C4N=C3.[Na]
InChi Code
InChI=1S/C30H44N7O17P3S.Na/c1-30(2,25(41)28(42)33-11-10-20(38)32-12-13-58-21(39)9-8-18-6-4-3-5-7-18)15-51-57(48,49)54-56(46,47)50-14-19-24(53-55(43,44)45)23(40)29(52-19)37-17-36-22-26(31)34-16-35-27(22)37;/h3-7,16-17,19,23-25,29,40-41H,8-15H2,1-2H3,(H,32,38)(H,33,42)(H,46,47)(H,48,49)(H2,31,34,35)(H2,43,44,45);/t19-,23-,24-,25+,29-;/m1./s1
InChi Key
JQNRMSBLNRRFRZ-GXEYHGSNSA-N
Shipping & Storage Information
Storage
-20°C
Shipping
Wet ice in continental US; may vary elsewhere
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    500 µg

    $64

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    1 mg

    $109

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    Product Description

    3-Phenylpropanoyl-coenzyme A (3-phenylpropanoyl-CoA) is a derivative of CoA (Item Nos. 16147 | 21499 | 21722) that contains the medium-chain and phenyl-substituted fatty acid 3-phenylpropanoic acid.1 It has been used as an enzymatic substrate in potential screening assays for medium-chain acyl-CoA dehydrogenase (MCAD) deficiency, an inborn error of fatty acid metabolism characterized by hypoketotic hypoglycemia, medium-chain dicarboxylic aciduria, and intolerance to fasting, in newborn-derived primary fibroblasts.

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Derks, T.G.J., Boer, T.S., van Assen, A., et al. Neonatal screening for medium-chain acyl-CoA dehydrogenase (MCAD) deficiency in The Netherlands: The importance of enzyme analysis to ascertain true MCAD deficiency. J. Inherit. Metab. Dis. 31(1), 88-96 (2008).