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219137-85-6

219137-85-6 structural image
Product Name: AC-YVAD-AFC
Formula: C33H36F3N5O10
Synonyms: Ac-YVAD-AFC;Caspase-1 Substrate VI, Fluorogenic - CAS 219137-85-6 - Calbiochem;Z-YVAD-AFC
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COMPUTED DESCRIPTORS

Molecular Weight 719.7 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 7
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 14
Exact Mass 719.24142685 g/mol
Monoisotopic Mass 719.24142685 g/mol
Topological Polar Surface Area 229 Ų
Heavy Atom Count 51
Formal Charge 0
Complexity 1360
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

PRODUCT INTRODUCTION

description

Ac-Tyr-Val-Ala-Asp-7-amino-4-trifluoromethylcoumarin is a tetrapeptide obtained by formal condensation of the C-terminal carboxy group of Ac-Tyr-Val-Ala-Asp with the amino group of 7-amino-4-trifluoromethylcoumarin. It has a role as a protease inhibitor. It is a tetrapeptide, a member of acetamides, a member of coumarins and an organofluorine compound. It is functionally related to a 7-amino-4-(trifluoromethyl)coumarin.