A Certified Reference Material
Features
  • This product is qualified as a Certified Reference Material (CRM) that has been manufactured and tested to meet ISO/IEC 17025 and ISO 17034 international standards
  • This CRM has been characterized by metrologically valid procedures and may be used as a quantitative analytical reference standard
  • Certificate of analysis provides the certified property values and the associated uncertainties, including a statement of metrological traceability for the certified values
  • Bulk material is available for qualified institutions; please contact our sales department for pricing
Related Products
Unlabeled Version(s)
15051AB-PINACA N-pentanoic acid metabolite
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AB-PINACA N-pentanoic acid metabolite-d4 (CRM)

A 100 µg/ml solution in methanol

Item No. 18145

Safety Data Sheet (SDS) (PDF)
Technical Information
Formal Name
(S)-5-(3-((1-amino-3-methyl-1-oxobutan-2-yl)carbamoyl)-1H-indazol-1-yl-d4)pentanoic acid
Molecular Formula
C18H20D4N4O4
Formula Weight
364.4
Formulation
A 100 µg/ml solution in methanol
SMILES
O=C(N[C@H](C(N)=O)C(C)C)C1=NN(CCCCC(O)=O)C2=C1C([2H])=C([2H])C([2H])=C2[2H]
InChi Code
InChI=1S/C18H24N4O4/c1-11(2)15(17(19)25)20-18(26)16-12-7-3-4-8-13(12)22(21-16)10-6-5-9-14(23)24/h3-4,7-8,11,15H,5-6,9-10H2,1-2H3,(H2,19,25)(H,20,26)(H,23,24)/t15-/m0/s1/i3D,4D,7D,8D
InChi Key
QNEBIXFSJOHXCK-ZGHLSHFDSA-N
Shipping & Storage Information
Storage
-20°C
Shipping
Room temperature in continental US; may vary elsewhere
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Certificates of Analysis & Batch Specific Data

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    100 µg

    $90

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    Product Description

    AB-PINACA N-pentanoic acid metabolite-d4 (CRM) (Item No. 18145) is intended for use as an internal standard for the quantification of AB-PINACA N-pentanoic acid metabolite (Item No. 15051) by GC- or LC-mass spectrometry (MS). AB-PINACA (Item No. 14038) is a synthetic cannabinoid (CB) that has been identified in illegal herbal products.1 AB-PINACA N-pentanoic acid metabolite is an expected compound produced by phase I metabolism of AB-PINACA in vivo, based on the metabolism of comparable alkylindole CBs.2,3 The physiological and toxicological properties of this compound have not been determined. This product is intended for research and forensic applications.

    WARNING This product is not for human or veterinary use.

    References & Product Citations
    Product Description References

    1. Uchiyama, N., Matsuda, S., Wakana, D., et al. New cannabimimetic indazole derivatives, N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-pentyl-1H-indazole-3-carboxamide (AB-PINACA) and N-(1-amino-3-methyl-1-oxobutan-2-yl)-1-(4-fluorobenzyl)-1H-indazole-3-carboxamide (AB-FUBINACA) identified as designer drugs in illegal products. Forensic Toxicol. 31(1), 93-100 (2013).

    2. Sobolevsky, T., Prasolov, I., and Rodchenkov, G. Detection of JWH-018 metabolites in smoking mixture post-administration urine. Forensic Sci. Int. 200(1-3), 141-147 (2010).

    3. Chimalakonda, K.C., Moran, C.L., Kennedy, P.D., et al. Solid-phase extraction and quantitative measurement of omega and omega-1 metabolites of JWH-018 and JWH-073 in human urine. Anal. Chem. 83(16), 6381-6388 (2011).