Description

(1S,2S,3aR,4S,5S,6E,9R,11R,12E,13aS)-1,2,3,4,5,8,9,10,11,13a-Decahydro-2,5,8,8,12-pentamethyl-3aH-cyclopentacyclododecene-1,3a,4,9,11-pentol 4,9,11-triacetate 1-benzoate is a complex, high-purity diterpenoid derivative with significant biological activity. This compound matters as a key advanced intermediate in the synthesis of novel pharmaceutical agents, offering researchers a precise chemical scaffold for drug discovery. It is primarily needed by pharmaceutical R&D and fine chemical synthesis laboratories focused on developing new therapeutic compounds.

Application

• Pharmaceutical Intermediate: Serves as a critical building block in the multi-step synthesis of novel drug candidates, particularly in oncology and anti-inflammatory research.
• Medicinal Chemistry Research: Used as a reference standard or a starting material for structure-activity relationship (SAR) studies to optimize biological potency.
• Biochemical Probe Development: Employed in the design and synthesis of molecular probes to study specific biological pathways and protein targets.
• Natural Product Analog Synthesis: Acts as a precursor for creating synthetic analogs of complex natural products with diterpenoid backbones.
• Process Chemistry Scale-up: Supplied to support the development and optimization of scalable synthetic routes for active pharmaceutical ingredients (APIs).
• Academic Research: Utilized in university and institutional labs for cutting-edge research in organic synthesis and chemical biology.

Basic Information

Item	Information
Product Name	(1S,2S,3aR,4S,5S,6E,9R,11R,12E,13aS)-1,2,3,4,5,8,9,10,11,13a-Decahydro-2,5,8,8,12-pentamethyl-3aH-cyclopentacyclododecene-1,3a,4,9,11-pentol 4,9,11-triacetate 1-benzoate
CAS No.	80454-47-3
Molecular Formula	C35H48O9
Molecular Weight	612.75 g/mol
Synonyms	Taxuspine X Triacetate Benzoate; 13-Deoxycinnzeylanol Triacetate Benzoate; (1S,2S,3aR,4S,5S,6E,9R,11R,12E,13aS)-1,2,3,4,5,8,9,10,11,13a-Decahydro-2,5,8,8,12-pentamethyl-3aH-cyclopentacyclododecene-1,3a,4,9,11-pentol 1-benzoate 4,9,11-triacetate; 13-Deoxycinnzeylanine Triacetate Benzoate; Taxuspine X 1-Benzoate-4,9,11-triacetate; A derivative of Taxuspine X
EINECS	Contact for details

Quality Control

Our (1S,2S,3aR,4S,5S,6E,9R,11R,12E,13aS)-1,2,3,4,5,8,9,10,11,13a-Decahydro-2,5,8,8,12-pentamethyl-3aH-cyclopentacyclododecene-1,3a,4,9,11-pentol 4,9,11-triacetate 1-benzoate is produced under strict quality management systems. Each batch undergoes comprehensive analytical testing, including HPLC for purity and identity confirmation via NMR and MS, to ensure it meets the exacting standards required for pharmaceutical research. Certificates of Analysis (COA) with full chromatographic data are available upon request.

Storage

Preserve in a tightly closed container, protected from light. Store at controlled room temperature (15-25°C) or as indicated on the label or COA. This compound is typically moisture-sensitive; keep the container tightly sealed in a dry environment.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (HPLC)	Retention time matches reference standard
Purity (HPLC)	≥ 97.0%
Related Substances (HPLC)	Total impurities ≤ 3.0%
Single Unknown Impurity	≤ 1.0%
Residual Solvents (GC)	Complies with ICH Q3C guidelines
Water Content (KF)	≤ 0.5%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.