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24940-57-6

24940-57-6 structural image
Product Name: N,N-DIMETHYL-HIS-OH
Formula: C8H13N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 183.21 g/mol
XLogP3 -2.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 183.100776666 g/mol
Monoisotopic Mass 183.100776666 g/mol
Topological Polar Surface Area 69.2 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 184
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
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

N(alpha),N(alpha)-dimethyl-L-histidine is the N(alpha),N(alpha)-dimethyl derivative of L-histidine. It has a role as a fungal metabolite. It is a tautomer of a N(alpha),N(alpha)-dimethyl-L-histidine zwitterion.