Ac-LEHD-AFC | 210345-03-2
Catelog Number | A18-0001 |
Category | Fluorescent Enzyme Substrates |
Molecular Formula | C33H38F3N7O11 |
Molecular Weight | 765.69 |
Catalog Number | Size | Price | Quantity |
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A18-0001 | -- | $-- |
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Product Introduction
Ac-LEHD-AFC is a fluorogenic substrate for caspase-4, 5 and 9.
Chemical Information |
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Synonyms | N-acetyl-L-leucyl-L-α-glutamyl-L-histidyl-N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-L-α-asparagine; N-Acetyl-Leu-Glu-His-Asp-7-amino-4-Trifluoromethylcoumarin; Caspase-9 substrate; L-α-Asparagine, N-acetyl-L-leucyl-L-α-glutamyl-L-histidyl-N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-; (4S,7S,10S,13S)-10-((1H-imidazol-5-yl)methyl)-7-(2-carboxyethyl)-4-isobutyl-2,5,8,11-tetraoxo-13-((2-oxo-4-(trifluoromethyl)-2H-chromen-7-yl)carbamoyl)-3,6,9,12-tetraazapentadecan-15-oic acid |
Purity | ≥95% |
IUPAC Name | (4S)-4-[[(2S)-2-acetamido-4-methylpentanoyl]amino]-5-[[(2S)-1-[[(2S)-3-carboxy-1-oxo-1-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]amino]propan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid |
Canonical SMILES | CC(C)CC(C(=O)NC(CCC(=O)O)C(=O)NC(CC1=CN=CN1)C(=O)NC(CC(=O)O)C(=O)NC2=CC3=C(C=C2)C(=CC(=O)O3)C(F)(F)F)NC(=O)C |
InChI | InChI=1S/C33H38F3N7O11/c1-15(2)8-22(39-16(3)44)31(52)41-21(6-7-26(45)46)29(50)42-23(9-18-13-37-14-38-18)32(53)43-24(12-27(47)48)30(51)40-17-4-5-19-20(33(34,35)36)11-28(49)54-25(19)10-17/h4-5,10-11,13-15,21-24H,6-9,12H2,1-3H3,(H,37,38)(H,39,44)(H,40,51)(H,41,52)(H,42,50)(H,43,53)(H,45,46)(H,47,48) |
InChI Key | HULKIXRFKRCRHD-ZJZGAYNASA-N |
Solubility | Soluble in DMF, DMSO |
Density | 1.457±0.06 g/cm3 (Predicted) |
Appearance | Slightly Yellow Powder |
Boiling Point | 1211.9±65.0°C (Predicted) |
Product Specification |
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Excitation | 400 nm |
Emission | 505 nm |
Storage | Store at -20°C |
Computed Properties | |
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XLogP3 | 0.2 |
Hydrogen Bond Donor Count | 8 |
Hydrogen Bond Acceptor Count | 15 |
Rotatable Bond Count | 18 |
Exact Mass | 765.25813954 g/mol |
Monoisotopic Mass | 765.25813954 g/mol |
Topological Polar Surface Area | 275Ų |
Heavy Atom Count | 54 |
Formal Charge | 0 |
Complexity | 1480 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 4 |
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 Number | Title | Priority Date |
---|---|---|
US-2016058847-A1 | IS100- A Highly Effective Enzyme Principle For Use In Dermal Therapeutics, And For Health And Beauty | 2014-09-03 |
WO-2004100888-A2 | N-thiolated azetidinones and anti-cancer use thereof | 2003-05-06 |
US-2004167115-A1 | Methods for preventing and treating cancer using N-thiolated beta-lactam compounds and analogs thereof | 2002-05-06 |
US-2006160787-A1 | Methods for preventing and treating cancer using N-thiolated beta-lactam compounds and analogs thereof | 2002-05-06 |
US-7026472-B2 | Methods for preventing and treating cancer using N-thiolated β-lactam compounds and analogs thereof | 2002-05-06 |
Applications of Fluorescent Probes & Dyes
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