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64291-41-4

64291-41-4 structure

64291-41-4 structure

Name: acetagastrodine
Chemical Name: 4-(Hydroxymethyl)phenyl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranosid e
CAS Number: 64291-41-4
Molecular Formula: C₂₁H₂₆O₁₁
Molecular Weight: 454.424
Catalog: API Nervous system medication 2 sedative and hypnotics
Create Date: 2018-08-23 15:18:30
Modify Date: 2026-07-03 18:20:42
Acetagastrodin (compound 4) is an intermediate for the synthesis of DBPG (an antioxidant from Origanum vulgare)[1].

Name	4-(Hydroxymethyl)phenyl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranosid e
Synonyms	p-hydroxymethylbenzonitrile 4-hydroxymethylbenzenecarbonitrile ACETAGASTRODINE β-D-Glucopyranoside, 4-(hydroxymethyl)phenyl, 2,3,4,6-tetraacetate p-cyanobenzyl alcohol ACETAGASTRODINE //BP β-D-Glucopyranoside, 4-(hydroxymethyl)phenyl, tetraacetate Acegastrodine [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-[4-(hydroxymethyl)phenoxy]oxan- 2-yl]methyl acetate 4-(Hydroxymethyl)phenyl β-D-glucopyranoside 2,3,4,6-tetraacetate 4-Cyanobenzyl alcohol (2R,3R,4S,5R,6S)-2-(AcetoxyMethyl)-6-(4-(hydroxyMethyl)phenoxy)tetrahydro-2H-pyran-3,4,5-triyl triacetate Gastrodin Impurity 12 2,3,4,6-Tetra-O-acetyl-4-(hydroxymethyl)phenyl-b-D-glucopyranoside 2,3,4,6-Tetra-O-acetyl-4-(hydroxymethyl)phenyl-beta-D-glucopyranoside 4-(Hydroxymethyl)phenyl-beta-D-glucopyranoside tetraacetate b-D-Glucopyranoside,4-(hydroxymethyl)phenyl, 2,3,4,6-tetraacetate 4-(Hydroxymethyl)phenyl 2,3,4,6-tetra-O-acetyl-β-D-glucopyranoside

Description	Acetagastrodin (compound 4) is an intermediate for the synthesis of DBPG (an antioxidant from Origanum vulgare)[1].
Related Catalog	Research Areas >> Others Signaling Pathways >> Others >> Others
References	[1]. Li YW, et, al. First and efficient synthesis of 4-(3,4-dihydroxybenzoyl-oxymethyl)-phenyl-O-β-D-glucopyranoside, an antioxidant from Origanum vulgare. Journal of the Serbian Chemical Society. 2015 Jan; 81(00):74-74.

Density	1.3±0.1 g/cm3
Boiling Point	551.4±50.0 °C at 760 mmHg
Molecular Formula	C₂₁H₂₆O₁₁
Molecular Weight	454.424
Flash Point	184.0±23.6 °C
Exact Mass	454.147522
PSA	143.89000
LogP	1.74
Vapour Pressure	0.0±1.6 mmHg at 25°C
Index of Refraction	1.538
Storage condition	2-8C

CHEMICAL IDENTIFICATION

RTECS NUMBER :: LZ5901800

CHEMICAL NAME :: beta-D-Glucopyranoside, 4-(hydroxymethyl)phenyl, 2,3,4,6-tetro-O-acetate

CAS REGISTRY NUMBER :: 64291-41-4

LAST UPDATED :: 199503

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C21-H26-O11

MOLECULAR WEIGHT :: 454.47

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: >18 gm/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: ZYZAEU Zhongguo Yaoxue Zazhi. Chinese Pharmacuetical Journal. (China International Book Trading Corp., POB 2820, Beijing, Peop. China) V.24- 1989- Volume(issue)/page/year: 24,244,1989

Precursor 0
DownStream 1
62499-27-8

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