D-a-Tocotrienol - ≥98% , CAS No.58864-81-6

CAS: 58864-81-6 Cat. No.: D304073 Molecular Weight: 424.68
AVAILABLE TO ORDER
GRADE & PURITY ≥98%
Synonyms
2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrienyl]-, (2R)- (9CI) | LMPR02020054 | (R)-.ALPHA.-TOCOTRIENOL | SCHEMBL242672 | .ALPHA.-TOCOTRIENOL [MI] | SCHEMBL16430461 | SR-01000946263-1 | CHEBI:33270 |
Storage
Protected from light,Store at -20°C,Argon charged
Shipped In
Ice chest + Ice pads
 ·  off list, applied to all prices below.
Size
Status
Price
Qty
1mg
D304073-1mg
3

$39.90

$59.90
Save $20.00 (33.39%)
5mg
D304073-5mg
3

$99.90

$149.90
Save $50.00 (33.36%)
20mg
D304073-20mg
3

$319.90

$479.90
Save $160.00 (33.34%)
50mg
D304073-50mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$426.90

$640.90
Save $214.00 (33.39%)
100mg
D304073-100mg
8-12 wks(?) Production requires sourcing of materials. We appreciate your patience and understanding.

$757.90

$1,136.90
Save $379.00 (33.34%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

🌡

Storage & shipping

Protected from light,Store at -20°C,Argon charged Ships Ice chest + Ice pads Check lot-specific COA for exact specifications.

📋

Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

📚

Literature proof

Cited in 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Product description
α-Tocotrienol is one of the isomers of vitamin E.
Product Application
α-Tocotrienol may be used as a reference standard for the analysis of α-Tocotrienol in cereals, in chicken meatand various food samples by high performance liquid chromatography (HPLC) equipped with fluorescence detection and in hazelnuts by normal phase HPLC combined with diode array detector (DAD)

Specifications

Synonyms
2H-1-Benzopyran-6-ol, 3, 4-dihydro-2, 5, 7, 8-tetramethyl-2-[(3E, 7E)-4, 8, 12-trimethyl-3, 7, 11-tridecatrienyl]-, (2R)- (9CI) | LMPR02020054 | (R)-.ALPHA.-TOCOTRIENOL | SCHEMBL242672 | .ALPHA.-TOCOTRIENOL [MI] | SCHEMBL16430461 | SR-01000946263-1 | CHEBI:33270 |
Specifications & Purity
≥98%
Biochemical and Physiological Mechanisms
Form of vitamin E. Lipophilic antioxidant agent. Tocotrienol β, δ and γ analog. Induces apoptosis in cancer cells. Shows antitumor, neuroprotective and antioxidant effects in vivo . Orally active.
Storage
Protected from light, Store at -20°C, Argon charged
Shipped In
Ice chest + Ice pads
This product requires cold chain shipping. Ground and other economy services are not available.
Note
Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.
Purity
≥98%
Names and Identifiers
Canonical SmilesCC1=C(C2=C(CCC(O2)(C)CCC=C(C)CCC=C(C)CCC=C(C)C)C(=C1O)C)C
IUPAC Name(2R)-2,5,7,8-tetramethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3,4-dihydrochromen-6-ol
InChIKeyRZFHLOLGZPDCHJ-XZXLULOTSA-N
INCHI1S/C29H44O2/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8)19-17-26-25(7)27(30)23(5)24(6)28(26)31-29/h12,14,16,30H,9-11,13,15,17-19H2,1-8H3/b21-14+,22-16+/t29-/m1/s1
Isomeric SMILES CC1=C(C2=C(CC[C@@](O2)(C)CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)C(=C1O)C)C
Alternate CAS 1721-51-3
Molecular Weight 424.68
Reaxy-Rn 1297053
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1297053&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassLipids and lipid-like molecules
ClassPrenol lipids
SubclassQuinone and hydroquinone lipids
Intermediate Tree Nodes Vitamin E compounds
Direct ParentTocotrienols
Alternative Parents Diterpenoids  1-benzopyrans  Alkyl aryl ethers  Benzenoids  Oxacyclic compounds  Hydrocarbon derivatives  
Molecular FrameworkAromatic heteropolycyclic compounds
Substituents Tocotrienol - Diterpenoid - 1-benzopyran - Benzopyran - Chromane - Alkyl aryl ether - Benzenoid - Oxacycle - Organoheterocyclic compound - Ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as tocotrienols. These are vitamin E derivatives containing an unsaturated trimethyltrideca-3,7,11-trien-1-yl chain attached to the carbon C6 atom of a benzopyran ring system. The differ from tocopherols that contain a saturated trimethyltridecyl chain.
External Descriptors Vitamin E
3D Structure
Interactive Chemical Structure Model





Associated Targets(Human)
MCF7 (126967 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
HepG2 (196354 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
MDA-MB-231 (73002 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Liver microsomes (16955 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Associated Targets(non-human)
Gallus gallus (1187 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Rattus norvegicus (775804 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot NumberCertificate TypeDateItem
K2323123Certificate of AnalysisOct 30, 2023 D304073
K2323124Certificate of AnalysisOct 30, 2023 D304073
K2323125Certificate of AnalysisOct 30, 2023 D304073
K2323126Certificate of AnalysisOct 30, 2023 D304073
K2323127Certificate of AnalysisOct 30, 2023 D304073
K2323128Certificate of AnalysisOct 30, 2023 D304073
Chemical and Physical Properties
SensitivityLight sensitive;Moisture sensitive
Molecular Weight424.700 g/mol
XLogP39.300
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count2
Rotatable Bond Count9
Exact Mass424.334 Da
Monoisotopic Mass424.334 Da
Topological Polar Surface Area29.500 Ų
Heavy Atom Count31
Formal Charge0
Complexity654.000
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds2
Covalently-Bonded Unit Count1
Citations of This Product
References
1. Wenjing Li, Ling Xiao, Juan Qi, Yuanyuan Zhang, Zhu Huang, Liangliang Zhu.  (2025)  β-Glucuronidase Acts as a Novel Nonantioxidative Target for Vitamin E.  JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY,      [PMID:40671374] [10.1021/acs.jafc.5c03447]
2. Shuo Zou, Hongzeng Ai, Pengkai Xie, Yee-Ying Lee, Ying Huang, Hong Shyang Pei, Mingchen Xu, Yong Wang, Zhen Zhang.  (2025)  Design and mechanistic insights of diacylglycerol-based microemulsions for enhanced transdermal delivery: experimental optimization and molecular dynamics simulation.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:41205530] [10.1016/j.jcis.2025.139399]
Solution Calculators
Reviews

Customer Reviews

Shall we send you a message when we have discounts available?

Remind me later

Thank you! Please check your email inbox to confirm.

Oops! Notifications are disabled.