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Homecas152509-78-9

152509-78-9

152509-78-9 structural image
Product Name: thiazohalostatin
Formula: C20H25Cl3N2O4S
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COMPUTED DESCRIPTORS

Molecular Weight 495.8 g/mol
XLogP3 5.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 10
Exact Mass 494.060062 g/mol
Monoisotopic Mass 494.060062 g/mol
Topological Polar Surface Area 117 Ų
Heavy Atom Count 30
Formal Charge 0
Complexity 706
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 4
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

methyl 2-[(Z)-9-hydroxy-4,6-dimethyl-7-oxo-9-(3,4,5-trichloro-1H-pyrrol-2-yl)non-8-en-2-yl]-4,5-dihydro-1,3-thiazole-4-carboxylate is a natural product found in Actinomadura with data available.