Anisodine Hydrobromide

Basic Information

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CAS Number

76822-34-9

Molecular Formula

C17H22BrNO5

Molecular Weight

400.27 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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CN1C2CC(CC1C3C2O3)OC(=O)C(CO)(C4=CC=CC=C4)O.Br

InChI

InChI=1S/C17H21NO5.BrH/c1-18-12-7-11(8-13(18)15-14(12)23-15)22-16(20)17(21,9-19)10-5-3-2-4-6-10;/h2-6,11-15,19,21H,7-9H2,1H3;1H/t11-,12-,13+,14-,15+,17-;/m1./s1

InChIKey

GJPDCORRBGIJOP-JYHRPVKFSA-N

LogP

0.5999999999999999

Topological Polar Surface Area

82.53 Å²

Hydrogen Bond Donor/Acceptor

2 / 6

Complexity

462

Synonyms & References

English

J3.145.635E
[(1R,2R,4S,5S)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl] (2S)-2,3-dihydroxy-2-phenylpropanoate;hydrobromide
AKOS027382060
Benzeneacetic acid, alpha-hydroxy-alpha-(hydroxymethyl)-, 9-methyl-3-oxa-9-azatricyclo(3.3.1.0(sup 2,4))non-7-yl ester, hydrobromide, (7(S)-(1-alpha,2-beta,4-beta,5-alpha,7-beta))-
(S)-(1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl2,3-dihydroxy-2-phenylpropanoatehydrobromide
(S)-(1R,2R,4S,5S,7s)-9-Methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl 2,3-dihydroxy-2-phenylpropanoate hydrobromide
3-alpha-(2',3'-Dihydroxy-2'-phenylpropionyloxy)-6-beta,7-beta-epoxytropane hydrochloride
BENZENEACETIC ACID, .ALPHA.-HYDROXY-.ALPHA.-(HYDROXYMETHYL)-, 9-METHYL-3-OXA-9-AZATRICYCLO(3.3.1.0(SUP 2,4))NON-7-YL ESTER, HYDROBROMIDE, (7(S)-(1.ALPHA.,2.BETA.,4.BETA.,5.ALPHA.,7.BETA.))-
Anisodine hydrobromide
1ST158259H
BENZENEACETIC ACID, .ALPHA.-HYDROXY-.ALPHA.-(HYDROXYMETHYL)-, (1.ALPHA.,2.BETA.,4.BETA.,5.ALPHA.,7.BETA.)-9-METHYL-3-OXA-9-AZATRICYCLO(3.3.1.0(SUP 2,4))NON-7-YL ESTER, HYDROBROMIDE (1:1), (.ALPHA.S)-
6JS7JS5B0F
AT (sub 3)
Q27265009
ANISODINE HYDROBROMIDE [WHO-DD]
76822-34-9
UNII-6JS7JS5B0F
CHEMBL5072828
[(1S,2S,4R,5R)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]nonan-7-yl] (2S)-2,3-dihydroxy-2-phenylpropanoate;hydrobromide
3-.ALPHA.-(2',3'-DIHYDROXY-2'-PHENYLPROPIONYLOXY)-6-.BETA.,7-.BETA.-EPOXYTROPANE HYDROCHLORIDE
ANISODINE HBR
Benzeneaceticacid, a-hydroxy-a-(hydroxymethyl)-, (1a,2b,4b,5a,7b)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-ylester, hydrobromide, (aS)- (9CI)
Benzeneacetic acid, a-hydroxy-a-(hydroxymethyl)-, 9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester,hydrobromide, [7(S)-(1a,2b,4b,5a,7b)]-
3-Oxa-9-azatricyclo[3.3.1.02,4]nonane, benzeneacetic acid deriv.

MDL Number

MFCD27986829

FAQ

What is Anisodine Hydrobromide (CAS: 76822-34-9)?

Anisodine Hydrobromide (CAS: 76822-34-9) is a chemical compound used as a pharmaceutical agent. It has a molecular formula of C17H22N2O.HBr and a molecular weight of approximately 321.08 g/mol. It is a white or slightly yellow crystalline powder with a bitter taste.

What are the main uses of Anisodine Hydrobromide (CAS: 76822-34-9)?

Anisodine Hydrobromide (CAS: 76822-34-9) is primarily used as an antispasmodic agent in the treatment of various gastrointestinal disorders. It is also used in the management of symptoms associated with digestive tract spasms and as an adjunct in the treatment of peptic ulcers.

Is Anisodine Hydrobromide (CAS: 76822-34-9) safe?

Anisodine Hydrobromide (CAS: 76822-34-9) is considered safe when used under medical supervision. However, it should be handled with care due to potential side effects such as dizziness, blurred vision, and dry mouth. Proper protective measures, such as gloves and goggles, should be used during handling.

How should Anisodine Hydrobromide (CAS: 76822-34-9) be stored?

Anisodine Hydrobromide (CAS: 76822-34-9) should be stored in a cool, dry place away from direct sunlight and heat. It should be kept in a tightly sealed container to prevent moisture absorption. The storage temperature should not exceed 25°C to ensure its stability and efficacy.