MedKoo Cat#: 463798 | Name: Neothalfine

Description:

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

Neothalfine is a potent natural anti-tumor agent against metastatic colorectal cancer, resulting in cell cycle arrest at the G2/M phase and inducing apoptosis through the dysfunction of mitochondria to trigger intrinsic apoptotic pathway by untargeted metabolomic method, mitochondrial membrane potential, and caspase-3/7 activity assay.

Chemical Structure

Neothalfine
Neothalfine
CAS#unknown

Theoretical Analysis

MedKoo Cat#: 463798

Name: Neothalfine

CAS#: unknown

Chemical Formula: C38H36N2O8

Exact Mass: 648.2472

Molecular Weight: 648.71

Elemental Analysis: C, 70.36; H, 5.59; N, 4.32; O, 19.73

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
Neothalfine;
IUPAC/Chemical Name
14,36,37,54-tetramethoxy-32-methyl-31,32,33,34-tetrahydro-2,6-dioxa-1(5,6)-[1,3]dioxolo[4,5-f]isoquinolina-3(5,1)-isoquinolina-5(1,3),7(1,4)-dibenzenacyclooctaphane
InChi Key
PCEQWUUFUJWIBW-UHFFFAOYSA-N
InChi Code
InChI=1S/C38H36N2O8/c1-40-15-13-24-26-19-31(42-3)35(43-4)34(24)48-36-32-25(33-38(37(36)44-5)46-20-45-33)12-14-39-27(32)16-21-6-9-23(10-7-21)47-30-18-22(17-28(26)40)8-11-29(30)41-2/h6-12,14,18-19,28H,13,15-17,20H2,1-5H3
SMILES Code
COC1=CC(C(CC2=CC=C(OC)C(OC3=CC=C(C4)C=C3)=C2)N(C)CC5)=C5C(OC6=C(OC)C7=C(OCO7)C8=C6C4=NC=C8)=C1OC
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 648.71 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: Zhu YY, Jin Q, Chen SS, Jin DN, Wang ZJ, He YJ, Chen HC, Zhao YL, Zhao LX, Dai Z, Luo XD. Neothalfine, a potent natural anti-tumor agent against metastatic colorectal cancer and its primary mechanism. Bioorg Med Chem. 2020 Nov 8:115849. doi: 10.1016/j.bmc.2020.115849. Epub ahead of print. PMID: 33221063. 2: Gao GY, Chen SB, Chen SL, Wang LW, Xiao PG. Novel dimeric alkaloids from the roots of Thalictrum atriplex. J Asian Nat Prod Res. 2005 Dec;7(6):805-9. doi: 10.1080/1028602042000204117. PMID: 16308195.