CAS 219138-08-6 Z-Val-Asp-Val-Ala-Asp-AFC (HCID 178906985)

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Basic information

CAS: 219138-08-6
Standard SMILES: CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)Nc1ccc2c(C(F)(F)F)cc(=O)oc2c1)C(C)C
InChIKey: FYZXTAPKQMDZKT-UXAYAQJLSA-N
Molecular formula: C39H45F3N6O13
Average molar mass: 862.8 g/mol

Names & identifiers

Preferred name: Z-Val-Asp-Val-Ala-Asp-AFC
IUPAC: (3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-3-carboxy-2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-4-oxo-4-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]amino]butanoic acid
English name: Z-VDVAD-AFC
Molecular formula: C39H45F3N6O13
Molecular weight: 862.8

Names & synonyms

Z-Val-Asp-Val-Ala-Asp-AFC219138-08-6(3S)-3-[[(2S)-2-[[(2S)-2-[[(2S)-3-carboxy-2-[[(2S)-3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoyl]amino]-3-methylbutanoyl]amino]propanoyl]amino]-4-oxo-4-[[2-oxo-4-(trifluoromethyl)chromen-7-yl]amino]butanoic acidZ-VDVAD-AFC (trifluoroacetate salt)MFCD01318834HY-P4400CS-0653827Z-VDVAD-AFCCBZ-VDVAD-AFCZ-VDVAD-AFC USP/EP/BPZ-Val-Asp-Ala-Asp-AFCCASPASE-2 SUBSTRATE I, FLUOROGENIC

Show more names

L-α-Asparagine,N-[(phenylmethoxy)carbonyl]-L-valyl-L-α-aspartyl-L-valyl-L-alanyl-N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-L-α-Asparagine, N-[(phenylmethoxy)carbonyl]-L-valyl-L-α-aspartyl-L-valyl-L-alanyl-N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]- (9CI)N-[(Phenylmethoxy)carbonyl]-L-valyl-L-alpha-aspartyl-L-valyl-L-alanyl-N-[2-oxo-4-(trifluoromethyl)-2H-1-benzopyran-7-yl]-L-alpha-asparagine

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 285 Å²
Hydrogen bond donors: 8
Hydrogen bond acceptors: 16
Rotatable bonds: 20
Heavy atoms: 61
Formal charge: 0
Complexity: 1,680

Physicochemical properties

Boiling point: 1153.6 · 1153.6±65.0 °C(Predicted)
Density: 1.399 · 1.399±0.06 g/cm3(Predicted)
storage temp.: -15 °C · -15°C
pka: 4.09 · 4.09±0.10(Predicted)
Sequence: {Z}-Val-Asp-Val-Ala-Asp-{AFC}

Chemistry & industry

Applications · 1 item

UsesZ-VDVAD-AFC is a fluorogenic substrate. Z-VDVAD-AFC is used to measure the activity of cysteine protease 3 (Caspase-3). Z-VDVAD-AFC undergoes hydrolysis to release 7-amino-4-trifluoromethylcoumarin (AFC). AFC is fluorescent under ultraviolet light and can emit fluorescent signals[1].

Suppliers28 total

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梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]

杭州思诺达医药科技有限责任公司0571-87213919 17306812703 · [email protected]

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