MedKoo Cat#: 525816 | Name: PD 109488
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

PD 109488 is a metabolite of quinapril. PD 109488, otherwise known as Quinapril Diketopiperazine, is a derivative of Quinapril that acts as an ACE inhibitor. Inhibition of ACE prevents the conversion of signaling peptide angiotensin I into angiotensin II, which acts as a potent vasoconstrictor. Reduced levels of angiotensin II also reduces the amount of aldosterone that is expressed due to RAAS signaling.

Chemical Structure

PD 109488
PD 109488
CAS#103733-49-9

Theoretical Analysis

MedKoo Cat#: 525816

Name: PD 109488

CAS#: 103733-49-9

Chemical Formula: C25H28N2O4

Exact Mass: 420.2049

Molecular Weight: 420.50

Elemental Analysis: C, 71.41; H, 6.71; N, 6.66; O, 15.22

Price and Availability

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50mg USD 1,340.00
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Related CAS #
No Data
Synonym
Quinapril Diketopiperazine; PD-109488; PD109488; PD 109488
IUPAC/Chemical Name
(S)-ethyl 2-((3S,11aS)-3-methyl-1,4-dioxo-3,4,11,11a-tetrahydro-1H-pyrazino[1,2-b]isoquinolin-2(6H)-yl)-4-phenylbutanoate
InChi Key
NDDYKENLGBOEPD-HSQYWUDLSA-N
InChi Code
InChI=1S/C25H28N2O4/c1-3-31-25(30)21(14-13-18-9-5-4-6-10-18)27-17(2)23(28)26-16-20-12-8-7-11-19(20)15-22(26)24(27)29/h4-12,17,21-22H,3,13-16H2,1-2H3/t17-,21-,22-/m0/s1
SMILES Code
O=C(OCC)[C@@H](N([C@@H](C)C1=O)C([C@@]2([H])N1CC3=C(C=CC=C3)C2)=O)CCC4=CC=CC=C4
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info
Product Data
Biological target:
PD 109488, otherwise known as Quinapril Diketopiperazine, is a derivative of Quinapril that acts as an ACE inhibitor.
In vitro activity:
TBD
In vivo activity:
TBD

Preparing Stock Solutions

The following data is based on the product molecular weight 420.50 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
Formulation protocol:
TBD
In vitro protocol:
TBD
In vivo protocol:
TBD
Kugler AR, Olson SC, Smith DE. Determination of quinapril and quinaprilat by high-performance liquid chromatography with radiochemical detection, coupled to liquid scintillation counting spectrometry. J Chromatogr B Biomed Appl. 1995 Apr 21;666(2):360-7. doi: 10.1016/0378-4347(94)00588-v. PMID: 7633615. Goto N, Sato T, Shigetoshi M, Ikegami K. Determination of dioxopiperazine metabolites of quinapril in biological fluids by gas chromatography-mass spectrometry. J Chromatogr. 1992 Jul 24;578(2):203-6. doi: 10.1016/0378-4347(92)80417-o. PMID: 1400798.