MedKoo Cat#: 592923 | Name: Aplysistatin

Description:

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

Aplysistatin is a bromosesquiterpene derived from sea mollusks.

Chemical Structure

Aplysistatin
Aplysistatin
CAS#62003-89-8

Theoretical Analysis

MedKoo Cat#: 592923

Name: Aplysistatin

CAS#: 62003-89-8

Chemical Formula: C15H21BrO3

Exact Mass: 328.0674

Molecular Weight: 329.23

Elemental Analysis: C, 54.72; H, 6.43; Br, 24.27; O, 14.58

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
Aplysistatin
IUPAC/Chemical Name
Furo(3,4-b)(1)benzoxepin-1(3H)-one, 7-bromo-3a,4a,5,6,7,8,8a,9-octahydro-4a,8,8-trimethyl-, (3aR-(3aalpha,4abeta,7beta,8aalpha))-
InChi Key
BEMNKPXNGWTBLQ-ASHKBJFXSA-N
InChi Code
InChI=1S/C15H21BrO3/c1-14(2)11-5-4-9-10(8-18-13(9)17)19-15(11,3)7-6-12(14)16/h4,10-12H,5-8H2,1-3H3/t10-,11-,12-,15-/m0/s1
SMILES Code
C12=CC[C@H]3C([C@H](CC[C@]3(C)O[C@H]2COC1=O)Br)(C)C
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 329.23 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: Couladouros EA, Vidali VP. Novel stereocontrolled approach to syn- and anti-oxepene-cyclogeranyl trans-fused polycyclic systems: asymmetric total synthesis of (-)-Aplysistatin, (+)-Palisadin A, (+)-Palisadin B, (+)-12-hydroxy-palisadin B, and the AB ring system of adociasulfate-2 and toxicol A. Chemistry. 2004 Aug 6;10(15):3822-35. PubMed PMID: 15281167. 2: Koshimura M, Utsukihara T, Kawamoto M, Saito M, Horiuchi CA, Kuniyoshi M. Biotransformation of bromosesquiterpenes by marine fungi. Phytochemistry. 2009 Dec;70(17-18):2023-6. doi: 10.1016/j.phytochem.2009.08.021. Epub 2009 Sep 21. PubMed PMID: 19772936. 3: Pettit GR, Herald CL, Allen MS, von Dreele RB, Vanell LD, Kao JP, Blake W. The isolation and structure of aplysistatin. J Am Chem Soc. 1977 Jan 5;99(1):262-3. PubMed PMID: 830682. 4: Su H, Yuan Z, Li J, Guo S, Han L, Zhu X, Shi D. [Studies on chemical constituents of Laurencia saitoi]. Zhongguo Zhong Yao Za Zhi. 2009 Apr;34(7):871-4. Chinese. PubMed PMID: 19623985. 5: Kuniyoshi M, Marma MS, Higa T, Bernardinelli G, Jefford CW. New bromoterpenes from the red alga Laurencia luzonensis. J Nat Prod. 2001 Jun;64(6):696-700. PubMed PMID: 11421726. 6: Su H, Shi DY, Li J, Guo SJ, Li LL, Yuan ZH, Zhu XB. Sesquiterpenes from Laurencia similis. Molecules. 2009 May 20;14(5):1889-97. doi: 10.3390/molecules14051889. PubMed PMID: 19471208.