Ac-VDVAD-AFC

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Ac-VDVAD-AFC

Ac-VDVAD-AFC | 210344-94-8

Catalog Number A18-0012
Category Fluorescent Enzyme Substrates
Molecular Formula C33H41F3N6O12
Molecular Weight 770.7
Catalog Number Size Price Quantity
A18-0012 -- $--

Product Introduction

Ac-VDVAD-AFC is a fluorogenic substrate whose amino acids VDVAD have been shown to be a preferred cleavage site for caspase-2. Caspase activity can be quantified by fluorescent detection of free AFC (7-amino-4-trifluoromethylcoumarin), which is excited at 400 nm and emits at 505 nm.

Chemical Information

Synonyms N-Acetyl-Val-Asp-Val-Ala-Asp-7-amino-4-Trifluoromethylcoumarin; N-acetyl-L-valyl-L-α-aspartyl-L-valyl-L-alanyl-N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-L-α-asparagine
Purity ≥95%
IUPAC Name (3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-acetamido-3-methylbutanoyl]amino]-3-carboxypropanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-4-oxo-4-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]amino]butanoic acid
Canonical SMILES CC(C)C(C(=O)NC(CC(=O)O)C(=O)NC(C(C)C)C(=O)NC(C)C(=O)NC(CC(=O)O)C(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)C(F)(F)F)NC(=O)C
InChI InChI=1S/C33H41F3N6O12/c1-13(2)26(38-16(6)43)32(53)41-21(12-24(46)47)30(51)42-27(14(3)4)31(52)37-15(5)28(49)40-20(11-23(44)45)29(50)39-17-7-8-18-19(33(34,35)36)10-25(48)54-22(18)9-17/h7-10,13-15,20-21,26-27H,11-12H2,1-6H3,(H,37,52)(H,38,43)(H,39,50)(H,40,49)(H,41,53)(H,42,51)(H,44,45)(H,46,47)
InChI Key BKQMJQIAIFEZJR-OIOUIRQFSA-N
Appearance Solid Powder
  • Product Specification
Excitation 400 nm
Emission 505 nm
Storage Store at -20°C

Computed Properties

XLogP3 0.4
Hydrogen Bond Donor Count 8
Hydrogen Bond Acceptor Count 15
Rotatable Bond Count 17
Exact Mass 770.27345525 g/mol
Monoisotopic Mass 770.27345525 g/mol
Topological Polar Surface Area 276Ų
Heavy Atom Count 54
Formal Charge 0
Complexity 1520
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

Patents

Publication NumberTitlePriority Date
US-2013096050-A1 Highly active polypeptides and methods of making and using the same 2010-04-22
US-2018193422-A1 Highly active polypeptides and methods of making and using the same 2010-04-22
US-9782454-B2 Highly active polypeptides and methods of making and using the same 2010-04-22
US-10772934-B2 Highly active polypeptides and methods of making and using the same 2010-04-22
US-2021205415-A1 Highly active polypeptides and methods of making and using the same 2010-04-22
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