 Home > Encyclopedia > Dihydroergotoxine

Dihydroergotoxine

Dihydroergotoxine structure

CAS No:
11032-41-0
Chemical Name:
Dihydroergotoxine
Synonyms:
Ergotoxine,dihydro-;Indolo[4,3-fg]quinoline,ergotoxine deriv.;8H-Oxazolo[3,2-a]pyrrolo[2,1-c]pyrazine,ergotoxine deriv.;Dihydroergotoxin;Dihydroergotoxine;DCCK;Co-dergocrine;DHETX;9,10-Dihydroergotoxine;Ergoloid;52502-76-8
Categories:
Active Pharmaceutical Ingredients > Circulatory System Drugs

Description

A mixture of three different hydrogenated derivatives of ERGOTAMINE: DIHYDROERGOCORNINE; DIHYDROERGOCRISTINE; and DIHYDROERGOCRYPTINE. Dihydroergotoxine has been proposed to be a neuroprotective agent and a nootropic agent. The mechanism of its therapeutic actions is not clear, but it can act as an alpha-adrenergic antagonist and a dopamine agonist. The methanesulfonate salts of this mixture of alkaloids are called ERGOLOID MESYLATES.

Dihydroergotoxine Basic Attributes

Molecular Weight：

679.78

Exact Mass：

679.267578

EC Number：

228-235-6

Characteristics

PSA：

180.96000

XLogP3：

2.87050

Appearance：

white powder

Water Solubility：

methanol: 21 mg/mL

Safety Information

wgk germany：

hazard class code：

20/21/22

safety instructions：

RTECS Number：

KE7920000

Marks：

GHS Classification：

|Warning|H312 (88%): Harmful in contact with skin [Warning Acute toxicity, dermal]|P261, P271, P280, P302+P352, P304+P312, P304+P340, P312, P322, P363, and P501|Aggregated GHS information provided by 50 companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH：

Drugs that bind to but do not activate alpha-adrenergic receptors thereby blocking the actions of endogenous or exogenous adrenergic agonists. Adrenergic alpha-antagonists are used in the treatment of hypertension, vasospasm, peripheral vascular disease, shock, and pheochromocytoma. (See all compounds classified as Adrenergic alpha-Antagonists.)|Drugs that bind to and activate dopamine receptors. (See all compounds classified as Dopamine Agonists.)

MeSH Entry Terms：

Alkaloids, Hydrogenated Ergot

Dihydroergotoxine Use and Manufacturing

Cognition adjuvant.

Computed Properties

Molecular Weight:679.8
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:4
Exact Mass:679.26758446
Monoisotopic Mass:679.26758446
Topological Polar Surface Area:181
Heavy Atom Count:48
Complexity:1260
Defined Atom Stereocenter Count:6
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes