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82-58-6

82-58-6 structural image
Product Name: 9,10-DIDEHYDRO-6-METHYL-ERGOLINE-8-CARBOXYLIC ACID
Formula: C16H16N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 268.31 g/mol
XLogP3 0
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 268.121177757 g/mol
Monoisotopic Mass 268.121177757 g/mol
Topological Polar Surface Area 56.3 Ų
Heavy Atom Count 20
Formal Charge 0
Complexity 461
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

Lysergic acid is an ergoline alkaloid comprising 6-methylergoline having additional unsaturation at the 9,10-position and a carboxy group at the 8-position. It derives from a hydride of a 6-methylergoline.