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MedKoo Cat#: 146059 | Name: Speciophylline

Description:

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

Speciophylline is a naturally occurring alkaloid compound found in certain plant species, particularly in the Psychotria genus. It exhibits potential pharmacological properties, including anti-inflammatory, analgesic, and antimalarial effects. Speciophylline works by interacting with specific receptors and enzymes in the body, helping to modulate inflammatory pathways and reduce pain. Its applications are being explored in the treatment of inflammatory diseases and malaria, offering a promising natural alternative for managing these conditions.

Chemical Structure

Speciophylline
Speciophylline
CAS#4697-68-1

Theoretical Analysis

MedKoo Cat#: 146059

Name: Speciophylline

CAS#: 4697-68-1

Chemical Formula: C21H24N2O4

Exact Mass: 368.1700

Molecular Weight: 368.43

Elemental Analysis: C, 68.46; H, 6.57; N, 7.60; O, 17.37

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
Speciophylline; NSC-113094; NSC113094; NSC 113094;
IUPAC/Chemical Name
methyl (1'S,3S,4a'S,5a'R,10a'S)-1'-methyl-2-oxo-4a',5',5a',7',8',10a'-hexahydro-1'H,10'H-spiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate
InChi Key
JMIAZDVHNCCPDM-ZUNJVLJPSA-N
InChi Code
1S/C21H24N2O4/c1-12-14-10-23-8-7-21(16-5-3-4-6-17(16)22-20(21)25)18(23)9-13(14)15(11-27-12)19(24)26-2/h3-6,11-14,18H,7-10H2,1-2H3,(H,22,25)/t12-,13-,14-,18+,21-/m0/s1
SMILES Code
[H][C@]12C[C@]3([H])C(=CO[C@@H](C)[C@]3([H])CN1CC[C@@]24C(=O)NC5=CC=CC=C45)C(=O)OC
Appearance
To be determined
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
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
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 368.43 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: Pierrot D, Sinou V, Bun SS, Parzy D, Taudon N, Rodriguez J, Ollivier E, Bonne D. Design and synthesis of simplified speciophylline analogues and β-carbolines as active molecules against Plasmodium falciparum. Drug Dev Res. 2019 Feb;80(1):133-137. doi: 10.1002/ddr.21494. Epub 2018 Nov 29. PMID: 30499121. 2: Paradowska K, Wolniak M, Pisklak M, Gliński JA, Davey MH, Wawer I. (13)C, (15)N CPMAS NMR and GIAO DFT calculations of stereoisomeric oxindole alkaloids from Cat's Claw (Uncaria tomentosa). Solid State Nucl Magn Reson. 2008 Nov;34(4):202-9. doi: 10.1016/j.ssnmr.2008.10.002. Epub 2008 Oct 22. PMID: 19019638. 3: Kaiser S, Dietrich F, de Resende PE, Verza SG, Moraes RC, Morrone FB, Batastini AM, Ortega GG. Cat's claw oxindole alkaloid isomerization induced by cell incubation and cytotoxic activity against T24 and RT4 human bladder cancer cell lines. Planta Med. 2013 Oct;79(15):1413-20. doi: 10.1055/s-0033-1350742. Epub 2013 Aug 23. PMID: 23975868. 4: Yepes-Pérez AF, Herrera-Calderon O, Sánchez-Aparicio JE, Tiessler-Sala L, Maréchal JD, Cardona-G W. Investigating Potential Inhibitory Effect of Uncaria tomentosa (Cat's Claw) against the Main Protease 3CLpro of SARS-CoV-2 by Molecular Modeling. Evid Based Complement Alternat Med. 2020 Sep 30;2020:4932572. doi: 10.1155/2020/4932572. PMID: 33029165; PMCID: PMC7532411. 5: Sánchez-Rojo S, Cerda-García-Rojas CM, Esparza-García F, Plasencia J, Poggi- Varaldo HM, Ponce-Noyola T, Ramos-Valdivia AC. Long-term response on growth, antioxidant enzymes, and secondary metabolites in salicylic acid pre-treated Uncaria tomentosa microplants. Biotechnol Lett. 2015 Dec;37(12):2489-96. doi: 10.1007/s10529-015-1931-0. Epub 2015 Aug 14. PMID: 26272395. 6: Bigliani MC, Rosso MC, Zunino PM, Baiardi G, Ponce AA. Anxiogenic-like effects of Uncaria tomentosa (Willd.) DC. aqueous extract in an elevated plus maze test in mice: a preliminary study. Nat Prod Res. 2013;27(18):1682-5. doi: 10.1080/14786419.2012.761617. Epub 2013 Jan 18. PMID: 23327494. 7: Luna-Palencia GR, Huerta-Heredia AA, Cerda-García-Rojas CM, Ramos-Valdivia AC. Differential alkaloid profile in Uncaria tomentosa micropropagated plantlets and root cultures. Biotechnol Lett. 2013 May;35(5):791-7. doi: 10.1007/s10529-012-1128-8. Epub 2013 Jan 8. PMID: 23296316. 8: Paniagua-Vega D, Cerda-García-Rojas CM, Ponce-Noyola T, Ramos-Valdivia AC. A new monoterpenoid oxindole alkaloid from Hamelia patens micropropagated plantlets. Nat Prod Commun. 2012 Nov;7(11):1441-4. PMID: 23285803. 9: Hossain R, Noonong K, Nuinoon M, Majima HJ, Eawsakul K, Sompol P, Rahman MA, Tangpong J. Network Pharmacology, Molecular Docking, and In Vitro Insights into the Potential of Mitragyna speciosa for Alzheimer's Disease. Int J Mol Sci. 2024 Dec 8;25(23):13201. doi: 10.3390/ijms252313201. PMID: 39684911; PMCID: PMC11642099. 10: de Matta SM, Monache FD, Ferrari F, Marini-Bettolo GB. Alkaloids and procyanidins of an Uncaria sp. from Peru. Farmaco Sci. 1976 Jul;31(7):527-35. PMID: 947783. 11: Toure H, Balansard G, Pauli AM, Scotto AM. Pharmacological investigation of alkaloids from leaves of Mitragyna inermis (Rubiaceae). J Ethnopharmacol. 1996 Oct;54(1):59-62. doi: 10.1016/0378-8741(96)01446-8. PMID: 8941870. 12: Fiot J, Sanon S, Azas N, Mahiou V, Jansen O, Angenot L, Balansard G, Ollivier E. Phytochemical and pharmacological study of roots and leaves of Guiera senegalensis J.F. Gmel (Combretaceae). J Ethnopharmacol. 2006 Jun 30;106(2):173-8. doi: 10.1016/j.jep.2005.12.030. Epub 2006 Jan 27. PMID: 16443341. 13: Fiot J, Baghdikian B, Boyer L, Mahiou V, Azas N, Gasquet M, Timon-David P, Balansard G, Ollivier E. HPLC quantification of uncarine D and the anti- plasmodial activity of alkaloids from leaves of Mitragyna inermis (Willd.) O. Kuntze. Phytochem Anal. 2005 Jan-Feb;16(1):30-3. doi: 10.1002/pca.806. PMID: 15688953.

View History

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