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MedKoo Cat#: 592309 | Name: Ajacine

Description:

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

Ajacine is an aconitum alkaloid found in various Delphinium species.

Chemical Structure

Ajacine
Ajacine
CAS#509-17-1

Theoretical Analysis

MedKoo Cat#: 592309

Name: Ajacine

CAS#: 509-17-1

Chemical Formula: C34H48N2O9

Exact Mass: 628.3400

Molecular Weight: 628.76

Elemental Analysis: C, 64.95; H, 7.70; N, 4.46; O, 22.90

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
Ajacine; Pontaconitine A
IUPAC/Chemical Name
Aconitane-7,8-diol, 4-(((2-(acetylamino)benzoyl)oxy)methyl)-20-ethyl-1,6,14,16-tetramethoxy-, (1alpha,6beta,14alpha,16eta)-
InChi Key
NUXFDCYXMLVOFU-AYBRVATOSA-N
InChi Code
InChI=1S/C34H48N2O9/c1-7-36-16-31(17-45-29(38)19-10-8-9-11-22(19)35-18(2)37)13-12-24(42-4)33-21-14-20-23(41-3)15-32(39,25(21)26(20)43-5)34(40,30(33)36)28(44-6)27(31)33/h8-11,20-21,23-28,30,39-40H,7,12-17H2,1-6H3,(H,35,37)/t20-,21-,23+,24+,25-,26+,27-,28+,30+,31+,32-,33+,34-/m1/s1
SMILES Code
CCN1C[C@@]2(CC[C@@H]([C@@]34[C@@H]5C[C@@H]6[C@@H](OC)C[C@@]([C@H]5[C@H]6OC)([C@@]([C@H]([C@H]23)OC)([C@@H]14)O)O)OC)COC(c7c(NC(C)=O)cccc7)=O
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
>3 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
2934.99.03.00
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 628.76 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: Borcsa B, Fodor L, Csupor D, Forgo P, Molnár A 5th, Hohmann J. Diterpene alkaloids from the roots of Aconitum moldavicum and assessment of Nav 1.2 sodium channel activity of aconitum alkaloids. Planta Med. 2014 Feb;80(2-3):231-6. doi: 10.1055/s-0033-1360278. Epub 2014 Jan 22. PubMed PMID: 24452459. 2: Kurtoğlu S, Sen B, Melikoğlu G, Becker H, Zapp J, Kiemer AK, Meriçli F, Meriçli AH. Diterpenoid alkaloids of Aconitum vulparia Rchb. Z Naturforsch C. 2012 Mar-Apr;67(3-4):103-7. PubMed PMID: 22624325. 3: Shrestha PM, Katz A. Diterpenoid alkaloids from the roots of Delphinium scabriflorum. J Nat Prod. 2004 Sep;67(9):1574-6. PubMed PMID: 15387663. 4: Shrestha PM, Katz A. Norditerpenoid alkaloids from the roots of Delphinium stapeliosum. J Nat Prod. 2000 Jan;63(1):2-5. PubMed PMID: 10650068. 5: Ameri A, Simmet T. Interaction of the structurally related aconitum alkaloids, aconitine and 6-benzyolheteratisine, in the rat hippocampus. Eur J Pharmacol. 1999 Dec 15;386(2-3):187-94. PubMed PMID: 10618469. 6: Ameri A, Simmet T. Antagonism of the aconitine-induced inexcitability by the structurally related Aconitum alkaloids, lappaconitine and ajacine. Brain Res. 1999 Sep 25;842(2):332-41. PubMed PMID: 10526129. 7: Venkateswarlu V, Srivastava SK, Joshi BS, Desai HK, Pelletier SW. 13-O-acetylvakhmatine, a new diterpenoid alkaloid from the seeds of Consolida ambigua. J Nat Prod. 1995 Oct;58(10):1527-32. PubMed PMID: 8676129. 8: Bai Y, Desai HK, Pelletier SW. N-oxides of some norditerpenoid alkaloids. J Nat Prod. 1995 Jun;58(6):929-33. PubMed PMID: 7673939.