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80111-48-4

80111-48-4 structural image
Product Name: L-Alanine, N-(cyclohexylcarbonyl)-, 11-ester with 20,23-didehydro-20,2 3-dideoxo-20,23-dihydroxyansatrienol A
Formula: C36H50N2O8
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COMPUTED DESCRIPTORS

Molecular Weight 638.8 g/mol
XLogP3 5.5
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 6
Exact Mass 638.35671656 g/mol
Monoisotopic Mass 638.35671656 g/mol
Topological Polar Surface Area 154 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 1110
Isotope Atom Count 0
Defined Atom Stereocenter Count 5
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 4
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Ansatrienin B is a natural product found in Streptomyces with data available.