dTAGV-1-NEG | CAS#2451573-87-6

MedKoo Cat#: 462766 | Name: dTAGV-1-NEG

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Description:

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

dTAGV-1-NEG is a negative control for dTAGV-1.

Chemical Structure

dTAGV-1-NEG

CAS#2451573-87-6

Theoretical Analysis

MedKoo Cat#: 462766

Name: dTAGV-1-NEG

CAS#: 2451573-87-6

Chemical Formula: C68H90N6O14S

Exact Mass: 1246.6236

Molecular Weight: 1247.56

Elemental Analysis: C, 65.47; H, 7.27; N, 6.74; O, 17.95; S, 2.57

Price and Availability

Size	Price	Availability	Quantity
5mg	USD 850.00	2 Weeks

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Related CAS #

No Data

Synonym

dTAGV-1-NEG;

IUPAC/Chemical Name

(R)-3-(3,4-dimethoxyphenyl)-1-(2-(2-((7-(((S)-1-((2R,4S)-4-hydroxy-2-(((S)-1-(4-(4-methylthiazol-5-yl)phenyl)ethyl)carbamoyl)pyrrolidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl)amino)-7-oxoheptyl)amino)-2-oxoethoxy)phenyl)propyl (S)-1-((S)-2-(3,4,5-trimethoxyphenyl)butanoyl)piperidine-2-carboxylate

InChi Key

ANLKEOUWAHUESE-SVUPEXKHSA-N

InChi Code

InChI=1S/C68H90N6O14S/c1-12-49(47-36-57(84-9)61(86-11)58(37-47)85-10)65(79)73-34-20-18-22-51(73)67(81)88-54(31-25-44-26-32-55(82-7)56(35-44)83-8)50-21-16-17-23-53(50)87-40-60(77)69-33-19-14-13-15-24-59(76)72-63(68(4,5)6)66(80)74-39-48(75)38-52(74)64(78)71-42(2)45-27-29-46(30-28-45)62-43(3)70-41-89-62/h16-17,21,23,26-30,32,35-37,41-42,48-49,51-52,54,63,75H,12-15,18-20,22,24-25,31,33-34,38-40H2,1-11H3,(H,69,77)(H,71,78)(H,72,76)/t42-,48-,49-,51-,52+,54+,63+/m0/s1

SMILES Code

C[C@@H](C1=CC=C(C2=C(C)N=CS2)C=C1)NC([C@H]3C[C@@H](CN3C([C@H](C(C)(C)C)NC(CCCCCCNC(COC4=CC=CC=C4[C@@H](CCC5=CC(OC)=C(C=C5)OC)OC([C@@H]6CCCCN6C([C@H](C7=CC(OC)=C(C(OC)=C7)OC)CC)=O)=O)=O)=O)=O)O)=O

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

>3 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

Product Data

Instruction

View handling instruction

Biological target:

dTAGV-1 is an FKBP12F36V-selective degrader.

In vitro activity:

This study describes dTAGV-1, an exclusively selective VHL-recruiting dTAG molecule, to rapidly degrade FKBP12F36V-tagged proteins. Reference: Nat Commun. 2020 Sep 18;11(1):4687. https://pubmed.ncbi.nlm.nih.gov/32948771/

In vivo activity:

TBD

	Solvent	mg/mL	mM
Solubility
	DMSO	124.8	100.00

Note: There can be variations in solubility for the same chemical from different vendors or different batches from the same vendor. The following factors can affect the solubility of the same chemical: solvent used for crystallization, residual solvent content, polymorphism, salt versus free form, degree of hydration, solvent temperature. Please use the solubility data as a reference only. Warming and sonication will facilitate dissolving. Still have questions? Please contact our Technical Support scientists.

Preparing Stock Solutions

The following data is based on the product molecular weight 1,247.56 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.

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:

1. Nabet B, Ferguson FM, Seong BKA, Kuljanin M, Leggett AL, Mohardt ML, Robichaud A, Conway AS, Buckley DL, Mancias JD, Bradner JE, Stegmaier K, Gray NS. Rapid and direct control of target protein levels with VHL-recruiting dTAG molecules. Nat Commun. 2020 Sep 18;11(1):4687. doi: 10.1038/s41467-020-18377-w. PMID: 32948771; PMCID: PMC7501296.

In vitro protocol:

In vivo protocol:

TBD