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VERRUCAROL is a naturally occurring sesquiterpene alcohol, an organic compound found in various plants and fungi. It is recognized for its potent anti-inflammatory and antimicrobial properties, which make it a valuable compound in both medicine and agriculture. Its chemical structure and biological activity have attracted interest for further research into its potential therapeutic applications, particularly in treating inflammatory and infectious diseases.

2198-92-7

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2198-92-7 Usage

Uses

Used in Pharmaceutical Industry:
VERRUCAROL is used as an anti-inflammatory agent for its ability to treat various inflammatory conditions, such as skin diseases and respiratory infections, due to its potent anti-inflammatory properties.
Used in Agricultural Industry:
VERRUCAROL is used as a natural fungicide for its potential in controlling fungal diseases in crops, leveraging its antimicrobial properties to protect plants from infections.
Used in Research and Development:
VERRUCAROL is used as a subject of interest for further research into its potential therapeutic applications, exploring its chemical structure and biological activity to discover new uses in medicine and agriculture.

Check Digit Verification of cas no

The CAS Registry Mumber 2198-92-7 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 2,1,9 and 8 respectively; the second part has 2 digits, 9 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 2198-92:
(6*2)+(5*1)+(4*9)+(3*8)+(2*9)+(1*2)=97
97 % 10 = 7
So 2198-92-7 is a valid CAS Registry Number.
InChI:InChI=1/C19H26O6/c1-11-5-6-18(9-22-12(2)20)15(7-11)25-16-8-14(24-13(3)21)17(18,4)19(16)10-23-19/h7,14-16H,5-6,8-10H2,1-4H3/t14-,15-,16-,17-,18-,19+/m1/s1

2198-92-7SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name VERRUCAROL

1.2 Other means of identification

Product number -
Other names 4BETA,15-DIHYDROXY-12,13-EPOXY-TRICHOTHEC-9-ENE

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:2198-92-7 SDS

2198-92-7Relevant academic research and scientific papers

Stereochemical correction and total structure of roridin J

Matsumoto, Manami,Ito, Atsushi,Tonouchi, Akio,Okazaki, Masaaki,Hashimoto, Masaru

, p. 5430 - 5435 (2017)

The (2′Z)-configuration of roridin J (1) was revised to the (2′E) form by conducting NOE experiments. Although the configurations with respect to the stereogenic carbons on the macrocyclic ring of 1 had remained unknown, a combination of NMR analysis and molecular modeling calculations revealed the (2′E,5′R,6′S,7′E,9′Z,13′S) form. In addition, the modeling calculations successfully reproduced the 1H and 13C NMR chemical shifts as well as the ECD spectrum. An X-ray crystallographic analysis verified all the relative configurations.

Total synthesis of (-)-verrucarol

Ishihara, Jun,Nonaka, Rie,Terasawa, Yuki,Shiraki, Ryota,Yabu, Kazuo,Kataoka, Hiromi,Ochiai, Yuichi,Tadano, Kin-Ichi

, p. 2679 - 2688 (2007/10/03)

We have achieved the total synthesis of (-)-verrucarol, a trichothecene sesquiterpenoid obtained as a hydrolysis product of the naturally occurring verrucarin A. Our total synthesis began with the previously reported enantiometrically pure bicyclic α-methylated γ-lactone, which was prepared from D-glucose. The key steps for the total synthesis were (1) aldol-like carbon-carbon bond formation applied to the starting lactone using a four- carbon aldehyde as an electrophile for introduction of the quaternary stereogenic carbon sharing the B and C-rings of the trichothecene skeleton, (2) Dieckmann cyclization of the derived ε-ester lactone for construction of the C-ring equivalent, (3) Barton's decarboxylative oxygenation for conversion of a carboxylic acid functionality in the Dieckmann cyclization product into a hydroxyl group, (4) skeletal enlargement strategy for the crucial trichothecene skeleton construction, and (5) the final stereoselective formation of the exo-epoxy ring at the methylene carbon in the bridge constituting the B and C-rings.

Total synthesis of (-)-verrucarol, a component of naturally occurring verrucarin A

Ishihara, Jun,Nonaka, Rie,Terasawa, Yuki,Shiraki, Ryota,Yabu, Kazuo,Kataoka, Hiromi,Ochiai, Yuichi,Tadano, Kin-Ichi

, p. 8311 - 8314 (2007/10/03)

Total synthesis of (-)-verrucarol (1) was achieved starting from D- glucose-derived bicyclic lactone 4 through 1) a stereoselective asymmetric quaternization of the α-carbon of the lactone, 2) Diechmann cyclization for access to the C-ring equivalent, 3) a skeletal rearrangement for the trichothecene ring system, and 4) the final stereoselective epoxidation of an exo-methylene group.

RORIDIN L-2, A NEW TRICHOTHECENE

Bloem, Russell J.,Smitka, Tim A.,Bunge, Richard H.,French, James C.,Mazzola, Eugene P.

, p. 249 - 252 (2007/10/02)

The structure (2) of roridin L-2 is shown to be a C29-trichothecene that lacks the macrocyclic lactone system usually present in the roridins.

Isolation and Characterization of the Trichoverroids and New Roridins and Verrucarins

Jarvis, Bruce B.,Stahly, G. Patrick,Pavanasasivam, Gowsala,Midiwo, Jacob O.,DeSilva, Tuley,Holmlund, Chester E.

, p. 1117 - 1124 (2007/10/02)

Myrothecium verrucaria grown on a large scale (760 L) has yielded a variety of new trichothecenes including the nonmacrocyclic trichoverroids 13-19, which contain a pendant C4 cis,trans-dienic ester side chain normally common only to the macrocyclic roridins and verrucarins.Several novel macrocyclic trichothecenes (roridins J and K acetate) and verrucarins L and L acetate also were isolated and characterized.

The ready conversion of anguidine into verrucarol and trichodermol

Tulshian, Deen Bandhu,Fraser-Reid, Bert

, p. 4549 - 4552 (2007/10/02)

Anguidine, 1, is readily converted into verrucarol diacetate, 2d, in 85 percent yield by application of the Barton-McCombie deoxygenation procedure. To enable conversion into trichodermol, 3a, the primary hydroxyl group of verrucarol, 2a, is selectively acetylated or is selectively acetylated or preferably silylated, thereby paving the way for its deoxygenation in three simple, high-yield reactions.

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