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Home > Encyclopedia > (3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

(3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

(3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid structure

(3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid 

structure
  • CAS No:

    137433-06-8

  • Formula:

    C11H20NO5P

  • Chemical Name:

    (3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

  • Synonyms:

    3-Isoquinolinecarboxylic acid,decahydro-6-(phosphonomethyl)-,(3S,4aR,6S,8aR)-;3-Isoquinolinecarboxylic acid,decahydro-6-(phosphonomethyl)-,[3S-(3α,4aα,6β,8aα)]-;(3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid;LY 235959;(3S,4AR,6S,8aR)-decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

(3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid Basic Attributes

277.25400

277.25

AR2BHC0C6P

Characteristics

116.67000

0.97190

1.339g/cm3

539.6ºC

280.1ºC

Drug Information

Agents used in the treatment of Parkinson's disease. The most commonly used drugs act on the dopaminergic system in the striatum and basal ganglia or are centrally acting muscarinic antagonists. (See all compounds classified as Antiparkinson Agents.)|Drugs that bind to but do not activate excitatory amino acid receptors, thereby blocking the actions of agonists. (See all compounds classified as Excitatory Amino Acid Antagonists.)

decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

Computed Properties

Molecular Weight:277.25
XLogP3:-2.9
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:277.10790974
Monoisotopic Mass:277.10790974
Topological Polar Surface Area:107
Heavy Atom Count:18
Complexity:368
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of (3S,4aR,6S,8aR)-Decahydro-6-(phosphonomethyl)-3-isoquinolinecarboxylic acid

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