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Ecgonidine

Ecgonidine structure

CAS No:
484-93-5
Formula:
C9H13NO2
Chemical Name:
Ecgonidine
Synonyms:
8-Azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid,8-methyl-,(1R,5S)-;8-Azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid,8-methyl-,(1R)-;(1R,5S)-8-Methyl-8-azabicyclo[3.2.1]oct-2-ene-2-carboxylic acid;Ecgonidine;Anhydroecgonine;1822302-46-4;1933763-34-8;2308484-81-1

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Ecgonidine Basic Attributes

Molecular Weight：

167.20 g/mol

Exact Mass：

167.21

EC Number：

207-610-8

Characteristics

PSA：

40.5 Å²

Melting Point：

228 °C (decomp)

Drug Information

MeSH Entry Terms：

(1S,5R)-8-methyl-8-azabicyclo(3.2.1)oct-2-ene-2-carboxylic acid

Computed Properties

Molecular Weight:167.20
XLogP3:-1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:167.094628657
Monoisotopic Mass:167.094628657
Topological Polar Surface Area:40.5
Heavy Atom Count:12
Complexity:247
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Ecgonidine

Basic Attributes
Characteristics
Drug Information
Computed Properties

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