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852955-00-1

852955-00-1 structural image
Product Name: CYCLO(-D-TRP-TYR)
Formula: C20H19N3O3
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COMPUTED DESCRIPTORS

Molecular Weight 349.4 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 349.14264148 g/mol
Monoisotopic Mass 349.14264148 g/mol
Topological Polar Surface Area 94.2 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 532
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
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

(3S,6R)-3-[(4-hydroxyphenyl)methyl]-6-(1H-indol-3-ylmethyl)piperazine-2,5-dione is a natural product found in Aspergillus fumigatus with data available.