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Betamethasone benzoate

Betamethasone benzoate structure

CAS No:
22298-29-9
Formula:
C29H33FO6
Chemical Name:
Betamethasone benzoate
Synonyms:
Pregna-1,4-diene-3,20-dione,17-(benzoyloxy)-9-fluoro-11,21-dihydroxy-16-methyl-,(11β,16β)-;Pregna-1,4-diene-3,20-dione,9-fluoro-11β,17,21-trihydroxy-16β-methyl-,17-benzoate;(11β,16β)-17-(Benzoyloxy)-9-fluoro-11,21-dihydroxy-16-methylpregna-1,4-diene-3,20-dione;Betamethasone 17-benzoate;Betamethasone benzoate;MS 1112;Beben;Flurobate;Bebate;W 5975;Benisone;Euvaderm;Uticort;Parbetan
Categories:
Analytical Chemistry > Standard

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Description

Betamethasone benzoate is a 21-hydroxy steroid.

Betamethasone benzoate Basic Attributes

Molecular Weight：

608.6936432

Exact Mass：

496.57

EC Number：

244-897-9

UNII：

877K0XW47A

DSSTox ID：

DTXSID2022670

HScode：

2937220000

Characteristics

PSA：

101

XLogP3：

3.9

Density：

1.1732 (estimate)

Melting Point：

225-228 °C

Toxicity：

LD50 scu-rat: 194 mg/kg TXAPA9 8,250,66

Specific rotation：

D24 +63.5° (dioxane)

Safety Information

Transport codes：

UN 2811 6.1 / PGII

wgk germany：

Precautionary statement(s)：

P201, P202, P260, P281, P308+P313, P314, P405, P501

Hazard Statements：

H360

GHS Classification：

|Danger|H360 (50%): May damage fertility or the unborn child [Danger Reproductive toxicity]|P201, P202, P260, P281, P308+P313, P314, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH：

A group of CORTICOSTEROIDS that affect carbohydrate metabolism (GLUCONEOGENESIS, liver glycogen deposition, elevation of BLOOD SUGAR), inhibit ADRENOCORTICOTROPIC HORMONE secretion, and possess pronounced anti-inflammatory activity. They also play a role in fat and protein metabolism, maintenance of arterial blood pressure, alteration of the connective tissue response to injury, reduction in the number of circulating lymphocytes, and functioning of the central nervous system. (See all compounds classified as Glucocorticoids.)|Substances that reduce or suppress INFLAMMATION. (See all compounds classified as Anti-Inflammatory Agents.)

MeSH Entry Terms：

betamethasone 17-benzoate

Betamethasone benzoate Use and Manufacturing

Uses

Betamethasone 17-Benzoate is an analog of Betamethasone (B327000), a glucocorticoid used as an anti-inflammatory agent.

Use Classification：

Human Drugs -> FDA Approved Drug Products with Therapeutic Equivalence Evaluations (Orange Book) -> Active Ingredients

Computed Properties

Molecular Weight:496.6
XLogP3:3.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:5
Exact Mass:496.22611693
Monoisotopic Mass:496.22611693
Topological Polar Surface Area:101
Heavy Atom Count:36
Complexity:1030
Defined Atom Stereocenter Count:8
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes