Acétate de vitamine E - ≥96% , CAS No.7695-91-2

CAS: 7695-91-2 Cat. No.: V107232 Formule: C₃₁H₅₂O₃ Poids moléculaire: 472.74 Beilstein Registry Number: 97512 Numéro CE: 231-710-0

GRADE & PURITY ≥96%

Synonyms

Fertilvit | Tocopheryl Acetate, dl-Alpha | DL-alpha-Tocopherol acetate | D-alpha -tocopherol acetate | IDI1_000803 | Pharmakon1600-00310040 | SPBio_000726 | Alpha-tocopheryl acetate, dl- | MLS001333082 | Tocopheryl acetate, dl-.alpha. | DTXSID20859032 | H

Storage

A conserver entre 2 et 8°C

Shipped In

Glace humide

Vue d’ensemble

α-Tocopherol is a predominant form of vitamin E in human and animal tissues and also in leaf chloroplasts. It is the major form in supplements. DL-α-Tocopherol acetate is considered as the only storage form of vitamin E.

Specifications

Synonymes

Fertilvit | Tocopheryl Acetate, dl-Alpha | DL-alpha-Tocopherol acetate | D-alpha -tocopherol acetate | IDI1_000803 | Pharmakon1600-00310040 | SPBio_000726 | Alpha-tocopheryl acetate, dl- | MLS001333082 | Tocopheryl acetate, dl-.alpha. | DTXSID20859032 | H

Spécifications et pureté

≥96%

Mécanismes biochimiques et physiologiques

Tocopherols (TCP) (vitamin E) are a series (α, β, γ and δ) of chiral organic molecules that vary in their degree of methylation of the phenol moiety of the chromanol ring. Tocopherols are lipid soluble anti-oxidants that protect cell membranes from oxidat

Conditions de stockage de stockage

A conserver entre 2 et 8°C

Expédié en

Glace humide

Pureté

≥96%

Noms et identifiants

Pubchem Sid

508814820

Sourires canoniques

CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OC(=O)C)C

IUPAC Name

[2,5,7,8-tetramethyl-2-(4,8,12-trimethyltridecyl)-3,4-dihydrochromen-6-yl] acetate

InChIKey

ZAKOWWREFLAJOT-UHFFFAOYSA-N

INCHI

1S/C31H52O3/c1-21(2)13-10-14-22(3)15-11-16-23(4)17-12-19-31(9)20-18-28-26(7)29(33-27(8)32)24(5)25(6)30(28)34-31/h21-23H,10-20H2,1-9H3

Isomères SMILES

CC1=C(C(=C(C2=C1OC(CC2)(C)CCCC(C)CCCC(C)CCCC(C)C)C)OC(=O)C)C

RTECS

GA8747000

Poids moléculaire

472.74

Beilstein

97512

Reaxy-Rn

455066

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=455066&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Prenol lipids
      • Subclass Quinone and hydroquinone lipids

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Prenol lipids
• Subclass: Quinone and hydroquinone lipids
• Intermediate Tree Nodes: Not available
• Direct Parent: Vitamin E compounds
• Alternative Parents: Diterpenoids 1-benzopyrans Alkyl aryl ethers Benzenoids Carboxylic acid esters Oxacyclic compounds Monocarboxylic acids and derivatives Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Diterpenoid - Chromane - Benzopyran - 1-benzopyran - Alkyl aryl ether - Benzenoid - Carboxylic acid ester - Carboxylic acid derivative - Oxacycle - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Aromatic heteropolycyclic compound
• Description: This compound belongs to the class of organic compounds known as vitamin e compounds. These are a group of fat-soluble compounds containing or derived either from a tocopherol or a tocotrienol skeleton.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Cibles associées (humaines)

PTH1R Tclin Parathyroid hormone receptor (47172 Activities)

Discover Target: PTH1R

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TDP1 Tchem Tyrosyl-DNA phosphodiesterase 1 (345557 Activities)

Discover Target: TDP1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)

Discover Target: SLCO1B3

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Cibles associées (non humaines)

ampC Beta-lactamase AmpC (62480 Activities)

Discover Target: ampC

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Plasmodium falciparum (966862 Activities)

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Mus musculus (284745 Activities)

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Aorta (2975 Activities)

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ffp 4'-phosphopantetheinyl transferase ffp (24982 Activities)

Discover Target: ffp

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Mécanismes d'action

Propriétés chimiques et physiques

• Solubilité: Insoluble in water; Miscible with Acetone,Chloroform,Ether; Soluble in Alcohol
• Sensibilité: Air sensitive
• Indice de réfraction: 1.497
• Point d'éclair (°F): 437 °F
• Point d'éclair (°C): 113 °C
• Point d'ébullition (°C): 224°C
• Poids moléculaire: 472.700 g/mol
• XLogP3: 10.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 14
• Exact Mass: 472.392 Da
• Monoisotopic Mass: 472.392 Da
• Topological Polar Surface Area: 35.500 Ų
• Heavy Atom Count: 34
• Formal Charge: 0
• Complexity: 601.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 3
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1