MedKoo Cat#: 413202 | Name: Delergotrile

Description:

WARNING: This product is for research use only, not for human or veterinary use.

Delergotrile is a biochemical

Chemical Structure

 Delergotrile
Delergotrile
CAS#59091-65-5

Theoretical Analysis

MedKoo Cat#: 413202

Name: Delergotrile

CAS#: 59091-65-5

Chemical Formula: C17H19N3

Exact Mass: 265.1579

Molecular Weight: 265.36

Elemental Analysis: C, 76.95; H, 7.22; N, 15.84

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
No Data
Synonym
Delergotrile; CM29712; CM-29712; CM 29712
IUPAC/Chemical Name
6-Methylergoline-8alpha-acetonitrile
InChi Key
LBMFWYCMCHRLBU-SGIREYDYSA-N
InChi Code
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
SMILES Code
[H][C@@]1(N(C)C[C@@H](CC#N)C[C@@]12[H])CC3=CNC4=C3C2=CC=C4
Appearance
Solid powder
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 - 4 C for short term (days to weeks) or -20 C for long term (months to years).
Solubility
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 265.36 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL
1: Beart PM, McDonald D, Cincotta M, de Vries DJ, Gundlach AL. Selectivity of some ergot derivatives for 5-HT1 and 5-HT2 receptors of rat cerebral cortex. Gen Pharmacol. 1986;17(1):57-62. doi: 10.1016/0306-3623(86)90011-x. PMID: 3949149. 2: Reavill C, Jenner P, Marsden CD. Differentiation of dopamine agonists using drug-induced rotation in rats with unilateral or bilateral 6-hydroxydopamine destruction of ascending dopamine pathways. Biochem Pharmacol. 1983 Mar 1;32(5):865-70. doi: 10.1016/0006-2952(83)90589-0. PMID: 6301501. 3: Vigouret JM, Bürki HR, Jaton AL, Züger PE, Loew DM. Neurochemical and neuropharmacological investigations with four ergot derivatives: bromocriptine, dihydroergotoxine, CF 25-397 and CM 29-712. Pharmacology. 1978;16 Suppl 1:156-73. doi: 10.1159/000136817. PMID: 565520. 4: Schelkunov EL, Andreeva OG, Korovin KF, Ostroumova MN. The functional role of the noradrenergic neurons in the thermoregulatory circuits in mice. J Neural Transm. 1981;50(2-4):113-37. doi: 10.1007/BF01249134. PMID: 6113267. 5: Rinne UK. Dopamine agonists as primary treatment in Parkinson's disease. Adv Neurol. 1987;45:519-23. PMID: 3103394. 6: Rinne UK. Dopamine agonists in the treatment of Parkinson's disease. Adv Neurol. 1983;37:141-50. PMID: 6305175. 7: Markstein R. Neurochemical effects of some ergot derivatives: a basis for their antiparkinson actions. J Neural Transm. 1981;51(1-2):39-59. doi: 10.1007/BF01664004. PMID: 6267192. 8: Jaton AL, Loew DM, Vigouret JM. A comparison of apomorphine, bromocriptine and Sandoz CM 29-712 (6-methyl-8a-cyanomethyl-ergoline-l) in four different turning models in the rat [proceedings]. Br J Pharmacol. 1978 Mar;62(3):395P. PMID: 565235; PMCID: PMC1668167. 9: Fuxe K, Ogren SO, Agnati LF, Andersson K, Hall H, Köhler C, Fredholm B. Central monoamine synapses as sites of action for ergot drugs. Adv Biochem Psychopharmacol. 1980;23:41-62. PMID: 6104914.