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METHYLLYCACONITINE CITRATE MLA:SYNTHETIC

METHYLLYCACONITINE CITRATE MLA:SYNTHETIC structure

CAS No:
21019-30-7
Formula:
C37H50N2O10
Chemical Name:
METHYLLYCACONITINE CITRATE MLA:SYNTHETIC
Synonyms:
Methyllycaconitine Citrate - CAS 21019-30-7 - Calbiochem;Aconitane-7,8-diol, 20-ethyl-4-(((2-(3-methyl-2,5-dioxo-1-pyrrolidinyl)benzoyl)oxy)methyl)-1,6,14,16-tetramethoxy-, (1-alpha,4(S),6-beta,14-alpha,16-beta)-;Brn 0076234;Lycaconitine, methyl-;Methyllycaconitine citrate (MLA);14,16-tetramethoxy-,(1-alpha,4(s),6-beta,14-alpha,16-beta)-oxy)methyl)-6;aconitane-7,8-diol,20-ethyl-4-(((2-(3-methyl-2,5-dioxo-1-pyrrolidinyl)benzoyl);delartine

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METHYLLYCACONITINE CITRATE MLA:SYNTHETIC Basic Attributes

Molecular Weight：

682.8

Exact Mass：

682.80

EC Number：

200-258-5

DSSTox ID：

DTXSID30333252

Color/Form：

white

Characteristics

PSA：

144 Å²

Density：

1.1852 (rough estimate)

Melting Point：

128 °C

Boiling Point：

694.34°C (rough estimate)

Refractive Index：

1.5300 (estimate)

PKA：

12.18±0.70(Predicted)

Critical Temperature & Pressure：

−20°C

Safety Information

wgk germany：

Drug Information

MeSH：

Drugs that bind to nicotinic cholinergic receptors (RECEPTORS, NICOTINIC) and block the actions of acetylcholine or cholinergic agonists. Nicotinic antagonists block synaptic transmission at autonomic ganglia, the skeletal neuromuscular junction, and at central nervous system nicotinic synapses. (See all compounds classified as Nicotinic Antagonists.)|Pesticides designed to control insects that are harmful to man. The insects may be directly harmful, as those acting as disease vectors, or indirectly harmful, as destroyers of crops, food products, or textile fabrics. (See all compounds classified as Insecticides.)

MeSH Entry Terms：

methyllycaconitine

Computed Properties

Molecular Weight:682.8
XLogP3:1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:10
Exact Mass:682.34654580
Monoisotopic Mass:682.34654580
Topological Polar Surface Area:144
Heavy Atom Count:49
Complexity:1380
Defined Atom Stereocenter Count:9
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Methyllycaconitine Citrate

CAS No.: 21019-30-7

Content: 97%

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Guide of METHYLLYCACONITINE CITRATE MLA:SYNTHETIC

Basic Attributes
Characteristics
Safety Information
Drug Information
Computed Properties
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