MedKoo Cat#: 596331 | Name: Junceellin

Description:

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

Junceellin is a bioactive chemical from gorgonian, Gorgonella umbraculum.

Chemical Structure

Junceellin
Junceellin
CAS#92508-09-3

Theoretical Analysis

MedKoo Cat#: 596331

Name: Junceellin

CAS#: 92508-09-3

Chemical Formula: C28H35ClO11

Exact Mass: 582.1868

Molecular Weight: 583.02

Elemental Analysis: C, 57.68; H, 6.05; Cl, 6.08; O, 30.19

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 #
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Synonym
Junceellin; (-)-Junceellin;
IUPAC/Chemical Name
(1R,3aR,4S,6S,7S,8R,8aR,9S,12aS,13S,13aR)-4-chloro-1,8a-dimethyl-5,12-dimethylene-2-oxotetradecahydro-5H-6,13a-epoxybenzo[4,5]cyclodeca[1,2-b]furan-7,8,9,13-tetrayl tetraacetate
InChi Key
PXWWTSQKNXBHTK-VQNAIMPISA-N
InChi Code
InChI=1S/C28H35ClO11/c1-11-9-10-18(35-14(4)30)27(8)19(11)23(37-16(6)32)28-13(3)26(34)39-24(28)20(29)12(2)21(40-28)22(36-15(5)31)25(27)38-17(7)33/h13,18-25H,1-2,9-10H2,3-8H3/t13-,18-,19+,20-,21-,22-,23-,24-,25-,27-,28+/m0/s1
SMILES Code
O=C1[C@H](C)[C@@]2([C@@H](OC(C)=O)[C@]3([H])[C@@]([C@@H](OC(C)=O)CCC3=C)(C)[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@](O2)([H])C([C@@H]4Cl)=C)[C@@]4([H])O1
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 583.02 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: Cheng W, Li X, Yin F, van Ofwegen L, Lin W. Halogenated Briarane Diterpenes with Acetyl Migration from the Gorgonian Coral Junceella fragilis. Chem Biodivers. 2017 May;14(5). doi: 10.1002/cbdv.201700053. PubMed PMID: 28337842. 2: Guo JZ, Liao XJ, Liu F, Xu SH. [Chemical constituents from Dichotella gemmacea]. Zhong Yao Cai. 2014 Feb;37(2):266-9. Chinese. PubMed PMID: 25095349. 3: Liaw CC, Shen YC, Lin YS, Hwang TL, Kuo YH, Khalil AT. Frajunolides E-K, briarane diterpenes from Junceella fragilis. J Nat Prod. 2008 Sep;71(9):1551-6. doi: 10.1021/np800126f. Epub 2008 Sep 6. PubMed PMID: 18774864. 4: Lin YC, Huang YL, Khalil AT, Chen MH, Shen YC. Juncenolides F and G, two new briarane diterpenoids from Taiwanese gorgonian Junceella juncea. Chem Pharm Bull (Tokyo). 2005 Jan;53(1):128-30. PubMed PMID: 15635248. 5: Qi SH, Zhang S, Huang H, Xiao ZH, Huang JS, Li QX. New briaranes from the South China Sea gorgonian Junceella juncea. J Nat Prod. 2004 Nov;67(11):1907-10. PubMed PMID: 15568788. 6: Sung PJ, Fan TY, Fang LS, Wu SL, Li JJ, Chen MC, Cheng YM, Wang GH. Briarane derivatives from the gorgonian coral Junceella fragilis. Chem Pharm Bull (Tokyo). 2003 Dec;51(12):1429-31. PubMed PMID: 14646324. 7: Garcia M, Rodriguez J, Jimenez C. Absolute structures of new briarane diterpenoids from junceella fragilis . J Nat Prod. 1999 Feb;62(2):257-60. PubMed PMID: 10075754. 8: Subrahmanyam C, Kulatheeswaran R, Ward RS. Briarane diterpenes from the Indian Ocean gorgonian Gorgonella umbraculum. J Nat Prod. 1998 Sep;61(9):1120-2. PubMed PMID: 9748378.