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MedKoo Cat#: 591407 | Name: Agastaquinone

Description:

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

Agastaquinone is a diterpenoid quinone which may have nonspecific cytotoxic activities against several human cancer cell lines in vitro (A549, SK-OV-3, SK-MEL-2, XF498, and HCT15).

Chemical Structure

Agastaquinone
Agastaquinone
CAS#172923-90-9

Theoretical Analysis

MedKoo Cat#: 591407

Name: Agastaquinone

CAS#: 172923-90-9

Chemical Formula: C20H20O5

Exact Mass: 340.1311

Molecular Weight: 340.38

Elemental Analysis: C, 70.58; H, 5.92; O, 23.50

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
Agastaquinone;
IUPAC/Chemical Name
1,4,7(8H)-Phenanthrenetrione, 10-hydroxy-3-methoxy-8,8-dimethyl-2-(1-methylethyl)-
InChi Key
STVUTFZJYUGHSD-UHFFFAOYSA-N
InChi Code
InChI=1S/C20H20O5/c1-9(2)14-17(23)16-12(21)8-11-10(6-7-13(22)20(11,3)4)15(16)18(24)19(14)25-5/h6-9,21H,1-5H3
SMILES Code
O=C1C(C(C)C)=C(OC)C(C2=C1C(O)=CC3=C2C=CC(C3(C)C)=O)=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
>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 340.38 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: Becker K, Schwaiger S, Waltenberger B, Fuchs D, Pezzei CK, Schennach H, Stuppner H, Gostner JM. Immunomodulatory Effects of Diterpene Quinone Derivatives from the Roots of Horminum pyrenaicum in Human PBMC. Oxid Med Cell Longev. 2018 Jan 14;2018:2980295. doi: 10.1155/2018/2980295. eCollection 2018. PubMed PMID: 29576845; PubMed Central PMCID: PMC5821946. 2: Zielińska S, Matkowski A. Phytochemistry and bioactivity of aromatic and medicinal plants from the genus Agastache (Lamiaceae). Phytochem Rev. 2014;13:391-416. Epub 2014 Apr 3. Review. PubMed PMID: 24899872; PubMed Central PMCID: PMC4032471. 3: Min BS, Hattori M, Lee HK, Kim YH. Inhibitory constituents against HIV-1 protease from Agastache rugosa. Arch Pharm Res. 1999 Feb;22(1):75-7. PubMed PMID: 10071964. 4: Lee HK, Oh SR, Kim JI, Kim JW, Lee CO. Agastaquinone, a new cytotoxic diterpenoid quinone from Agastache rugosa. J Nat Prod. 1995 Nov;58(11):1718-21. PubMed PMID: 8594148.