α-tocotrienol (Q171833)

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chemical compound

alpha-Tocotrienol
zeta1-tocopherol
D-alpha-Tocotrienol
delta-alpha-Tocotrienol
(2R)-2,5,7,8-tetramethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-1-benzopyran-6-ol
(R)-alpha-tocotrienol
(2R,3'E,7'E)-alpha-Tocotrienol

Language	Label	Description	Also known as
English	α-tocotrienol	chemical compound	alpha-Tocotrienol zeta1-tocopherol D-alpha-Tocotrienol delta-alpha-Tocotrienol (2R)-2,5,7,8-tetramethyl-2-[(3E,7E)-4,8,12-trimethyltrideca-3,7,11-trien-1-yl]-3,4-dihydro-2H-1-benzopyran-6-ol (R)-alpha-tocotrienol (2R,3'E,7'E)-alpha-Tocotrienol

Statements

type of chemical entity

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DL-α-tocotrienol

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image of molecular model or crystal lattice model

Alpha-tocotrienol-bns.png
1,538 × 500; 266 KB

ball-and-stick model

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424.334131 dalton

1 reference

language of work or name

alpha-Tocotrienol (English)

5 October 2016

stereoisomer of

(2R)-2,5,7,8-tetramethyl-2-[(7E)-4,8,12-trimethyltrideca-3,7,11-trienyl]-3,4-dihydrochromen-6-ol

2 references

based on heuristic

inferred from InChIKey

based on heuristic

inferred from InChI

(2R)-2beta,5,7,8-Tetramethyl-2-[(3Z,7E)-4,8,12-trimethyl-3,7,11-tridecatrienyl]-3,4-dihydro-2H-1-benzopyran-6-ol

1 reference

based on heuristic

inferred from InChI

chemical formula

C₂₉H₄₄O₂

1 reference

language of work or name

alpha-Tocotrienol (English)

20 November 2016

canonical SMILES

CC1=C(C(=C2CCC(OC2=C1C)(C)CCC=C(C)CCC=C(C)CCC=C(C)C)C)O

1 reference

language of work or name

alpha-Tocotrienol (English)

20 November 2016

isomeric SMILES

CC1=C(C(=C2CC[C@@](OC2=C1C)(C)CC/C=C(\C)/CC/C=C(\C)/CCC=C(C)C)C)O

1 reference

language of work or name

alpha-Tocotrienol (English)

20 November 2016

2 references

Recon 2.2: from reconstruction to model of human metabolism

A community-driven global reconstruction of human metabolism.

Amaranthus cruentus

1 reference

Vitamin E isomers in grain amaranths (Amaranthus spp.)

Hippophae rhamnoides

1 reference

Effects of different origins and harvesting time on vitamin C, tocopherols, and tocotrienols in sea buckthorn (Hippophaë rhamnoides) berries.

2 references

Identification and quantitation of γ-oryzanol components and simultaneous assessment of tocols in rice bran oil

Isolation and identification of novel tocotrienols from rice bran with hypocholesterolemic, antioxidant, and antitumor properties

Aronia melanocarpa

1 reference

Lipid composition of Bulgarian chokeberry, black currant and rose hip seed oils

1 reference

Chemical composition of seeds of four Bulgarian grape varieties

subject has role

1 reference

Medical Subject Headings

MeSH descriptor ID

15 March 2018

Identifiers

InChI=1S/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

1 reference

language of work or name

alpha-Tocotrienol (English)

20 November 2016

RZFHLOLGZPDCHJ-XZXLULOTSA-N

2 references

language of work or name

alpha-Tocotrienol (English)

20 November 2016

ChEBI release 2020-09-01

CAS Registry Number

2 references

Global Substance Registration System

language of work or name

α-tocotrienol (English)

20 November 2016

RZFHLOLGZPDCHJ-XZXLULOTSA-N

CAS Common Chemistry

9 April 2021

https://commonchemistry.cas.org/detail?cas_rn=58864-81-6

1 reference

language of work or name

alpha-Tocotrienol (English)

20 November 2016

1 reference

language of work or name

alpha-Tocotrienol (English)

20 November 2016

Reaxys registry number

5484296

1 reference

language of work or name

alpha-tocotrienol (English)

5 October 2016

45723

1 reference

language of work or name

alpha-tocotrienol (English)

5 October 2016

mapping relation type

1 reference

language of work or name

ALPHA-TOCOTRIENOL (English)

20 November 2016

1 reference

language of work or name

ALPHA-TOCOTRIENOL (English)

20 November 2016

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

RZFHLOLGZPDCHJ-XZXLULOTSA-N

UniChem compound ID

1 reference

MassBank accession ID

MSBNK-RIKEN-PR100477

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splash10-004i-0000900000-42ad20e8d6a9720b5f40

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splash10-016r-0820900000-c5ea9f112b43d153109a

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splash10-014i-0910000000-325ff8b21aab0976b0ea

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splash10-014i-0900000000-8819d563e9143afbb96c

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splash10-014i-0900000000-7ad14be635c4bf259bbb

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splash10-01r2-9800300000-d4d5035c7c70dc5d3917

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611-757-7

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrien-1-yl]-, (2R)- (English)

CAS no.: 58864-81-6 (English)

ECHA Substance Infocard ID

1 reference

ECHA Substance Infocard database

ECHA Substance Infocard ID

27 December 2018

2H-1-Benzopyran-6-ol, 3,4-dihydro-2,5,7,8-tetramethyl-2-[(3E,7E)-4,8,12-trimethyl-3,7,11-tridecatrien-1-yl]-, (2R)- (English)

CAS no.: 58864-81-6 (English)

Cannabis Database ID

1 reference

Cannabis Database

MeSH descriptor ID

1 reference

Medical Subject Headings

MeSH descriptor ID

14 March 2018

Human Metabolome Database ID

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

RZFHLOLGZPDCHJ-XZXLULOTSA-N

1 reference

Global Substance Registration System

language of work or name

α-tocotrienol (English)

20 November 2016

Probes And Drugs ID

0 references

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Microsoft Academic ID

0 references

1 reference

based on heuristic

inferred by common MeSH mappings on source and on Wikidata

25 May 2023

Sitelinks

Wikipedia(6 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)

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