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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H19N3
Molecular Weight 265.3529
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DELERGOTRILE

SMILES

[H][C@@]12CC3=CNC4=C3C(=CC=C4)[C@@]1([H])C[C@H](CC#N)CN2C

InChI

InChIKey=LBMFWYCMCHRLBU-SGIREYDYSA-N
InChI=1S/C17H19N3/c1-20-10-11(5-6-18)7-14-13-3-2-4-15-17(13)12(9-19-15)8-16(14)20/h2-4,9,11,14,16,19H,5,7-8,10H2,1H3/t11-,14+,16+/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H19N3
Molecular Weight 265.3529
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Delergotrile is a derivative of ergot alkaloids with dopaminergic and anti-parkinsonian action. Delergotine shows neuropharmacological action typical of postsynaptic dopamine D1 receptor stimulants, in particular in the extrapyramidal system. In addition, delergotine stimulates adenylate cyclase coupled serotonin receptors and antagonize central alpha-adrenergic receptors. The compound was studied in the clinical trials, in new, non-levodopa-treated parkinsonian patients. Delergotine elicited a significant but mostly only mild or moderate antiparkinsonian efficacy which seems to be less than that of levodopa.

Approval Year

PubMed

PubMed

TitleDatePubMed
Ergot alkaloids. New ergolines as selective dopaminergic stimulants.
1978 Aug
Substance Class Chemical
Created
by admin
on Sat Dec 16 17:10:30 GMT 2023
Edited
by admin
on Sat Dec 16 17:10:30 GMT 2023
Record UNII
3U2FEE7NXX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DELERGOTRILE
INN  
INN  
Official Name English
6-METHYLERGOLINE-8.ALPHA.-ACETONITRILE
Systematic Name English
delergotrile [INN]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C66884
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
NCI_THESAURUS C38149
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
Code System Code Type Description
CAS
59091-65-5
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
EVMPD
SUB06951MIG
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
EPA CompTox
DTXSID101024216
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
INN
4694
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
NCI_THESAURUS
C79112
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
PUBCHEM
10264850
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
ChEMBL
CHEMBL174095
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
SMS_ID
100000083480
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
FDA UNII
3U2FEE7NXX
Created by admin on Sat Dec 16 17:10:30 GMT 2023 , Edited by admin on Sat Dec 16 17:10:30 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY