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클로베타솔프로피오네이트

Clobetasol Propionate

HCID 32798
노트반응
기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
부분 구조 검색유사 구조 찾기

기본 정보

CAS
25122-46-7
표준 SMILES
CCC(=O)O[C@]1(C(=O)CCl)[C@@H](C)C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]21C
InChIKey
CBGUOGMQLZIXBE-XGQKBEPLSA-N
분자식
C25H32ClFO5
평균 분자량
467 g/mol
단동위원소 질량
466.19223

개요

Clobetasol Propionate can cause developmental toxicity and female reproductive toxicity according to state or federal government labeling requirements.

이름 및 식별자

우선 이름
Clobetasol Propionate
IUPAC
[(8S,9R,10S,11S,13S,14S,16S,17R)-17-(2-chloroacetyl)-9-fluoro-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate
현지명
클로베타솔프로피오네이트
영어명
Clobetasol propionate
분자식
C25H32ClFO5
분자량
466.97

이름 및 동의어

CLOBETASOL PROPIONATE25122-46-7Clobetasol 17-propionateClobexDermovateTemovateEmbelineCormaxOluxEmbeline ETemovate EOlux-E
이름 더 보기
클로베타솔프로피오네이트CLOBETASOLE PROPIONATECLOBETASOL-17-PROPIONATE17-propionateClobetazole propionate21-Chloro-9-fluoro-11b,17-dihydroxy-16b-methylpregna-1,4-diene-3,20-dione 17-propionate
ImpoyzPsorexCCI 4725GR 2/925clobetasol 17-propanoateOlux EClareluxDovate

데이터베이스 식별자

CAS
25122-46-7
PubChem CID
32798
DTXSID
DTXSID6045907
ChEMBL
CHEMBL1159650
ChEBI
CHEBI:31414
UNII
779619577M
EC Number
246-634-3
Nikkaji

물성

구조 계산 물성

XLogP
3.8
극성 표면적
80.7 Ų
수소 결합 공여자 수
1
수소 결합 수용자 수
6
회전 가능 결합 수
5
무거운 원자 수
32
형식 전하
0
복잡도
929

실험 및 물리화학적 성질

Drugs · 2건

Pharmaceuticals -> Dermatologicals -> Corticosteroids, dermatological preparations

Pharmaceuticals -> Listed in ZINC15

LogP3.18
Human Drugs · 3건

FDA approved drugs -> Active ingredient

FDA approved drugs -> Active ingredient

Pharmaceuticals

Endocrine DisruptorsPotential endocrine disrupting compound
Collision Cross Section205.1 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

물리화학적 성질

녹는점
195.5 · 195.5-1970C
끓는 점
569 · 569.0±50.0 °C(Predicted)
밀도
1.1653 · 1.1653 (estimate)
저장 조건
2 · Keep in dark place,Sealed in dry,2-8°C
용해도
물에는 거의 녹지 않으며, 아세톤에는 잘 녹고, 에탄올에는 거의 녹지 않습니다(96%).
산도 계수 (pKa)
12.88 · 12.88±0.70(Predicted)
물리적 상태
Solid

안전 및 규제

안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.

GHS 분류

GHS Classification · 4건

Danger

H315 (34.1%): Causes skin irritation [Warning Skin corrosion/irritation]

P203, P260, P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 91 reports by companies from 19 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory Information · 2건

Hazard Traits - Developmental Toxicity; Reproductive Toxicity

Clobetasol propionate: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Pregna-1,4-diene-3,20-dione, 21-chloro-9-fluoro-11-hydroxy-16-methyl-17-(1-oxopropoxy)-, (11.beta.,16.beta.)-: Environment tier I assessment
Hazard Classes and CategoriesSkin Irrit. 2 (34.1%)

안전 데이터

wgk
2
rtecs
TU3725000
HS 번호
29372290
risk_code
36/37/38-62-53-48/20/21-61
hazard_code
Xi,T
safety_code
26-36-45-36/37-53
Hazard Classifications
Aquatic Chronic 4Repr. 1BSTOT RE 2
스토리지 클래스
6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects

화학 및 산업

약리 정보

Protein BindingData regarding the protein binding of clobetasol propionate are not readily available. Corticosteroids are generally bound to corticosteroid binding globulin and serum albumin in plasma.
Pharmacodynamics · 1건

Corticosteroids bind to the glucocorticoid receptor, inhibiting pro-inflammatory signals, and promoting anti-inflammatory signals. Clobetasol propionate is generally applied twice daily so the duration of action is long. Corticosteroids have a wide therapeutic window as patients may require doses that are multiples of what the body naturally produces. Patients taking corticosteroids should be counselled regarding the risk of hypothalamic-pituitary-adrenal axis suppression and increased susceptibility to infections.

Mechanism of Action · 1건

The short term effects of corticosteroids are decreased vasodilation and permeability of capillaries, as well as decreased leukocyte migration to sites of inflammation. Corticosteroids binding to the glucocorticoid receptor mediates changes in gene expression that lead to multiple downstream effects over hours to days. Glucocorticoids inhibit neutrophil apoptosis and demargination; they inhibit phospholipase A2, which decreases the formation of arachidonic acid derivatives; they inhibit NF-Kappa B and other inflammatory transcription factors; they promote anti-inflammatory genes like interleukin-10. Lower doses of corticosteroids provide an anti-inflammatory effect, while higher doses are immunosuppressive. High doses of glucocorticoids for an extended period bind to the mineralocorticoid receptor, raising sodium levels and decreasing potassium levels.

Biological Half-LifeData regarding the half life of clobetasol propionate are not readily available.
Metabolism/Metabolites · 1건

The metabolism of clobetasol propionate is not well studied but it does induce metabolic enzymes, even when delivered topically. The metabolism of clobetasol propionate is predicted to follow similar metabolic pathways to other corticosteroids including the addition of oxygen, hydrogen, glucuronides, and sulfates to form water soluble metabolites.

관련 반응

0건
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현재 필터 조건에 해당하는 반응 기록이 없습니다.

화합물 노트

불러오는 중…

이 페이지에서기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
J21.005F
색상
White to off-white
주요 응용
법의학 및 독성학수의사
InChIKey
CBGUOGMQLZIXBE-XGQKBEPLSA-N
SMILES
O([C@@]1([C@H](C[C@@]2([H])[C@]3([H])CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]12C)C)C(=O)CCl)C(=O)CC |&1:1,2,4,6,16,18,20,23,r|

화학적 성질

White or almost white, crystalline powder.

FDA Pharmacological Classification · 6건

CLOBETASOL PROPIONATE

Corticosteroid Hormone Receptor Agonists [MoA]; Corticosteroid [EPC]

CLOBETASOL PROPIONATE CREAM USP, 0.05%

Corticosteroid [EPC]; Corticosteroid Hormone Receptor Agonists [MoA]

CLOBETASOL PROPIONATE OINTMENT USP, 0.05%

Corticosteroid [EPC]; Corticosteroid Hormone Receptor Agonists [MoA]

MeSH Pharmacological Classification · 2건

Substances that reduce or suppress INFLAMMATION.

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.

Absorption, Distribution and Excretion · 4건

Twice daily application of clobetasol foam leads to a Cmax of 59±36pg/mL with a Tmax of 5 hours. Clobetasol cream showed an increase in clobetasol concentrations from 50.7±96.0pg/mL to 56.3±104.7pg/mL.

Corticosteroids are eliminated predominantly in the urine.

Data regarding the volume of distribution of clobetasole propionate are not readily available.

Data regarding the clearance of clobetasol propionate are not readily available.

용도 및 제조

Use ClassificationPharmaceuticals
응용 분야 · 1건

용도Topical corticosteroid. Glucocorticoid; anti-inflammatory. Clobetasol propionate (Cormax, Temovate, Embeline, Olux) is one of the most potent of the currently available agents and is indicated for short-term treatment of inflammatory or hyperplastic disorders. It is a synthetic fluorinated corticosteroid. It may cause a more rapid or prolonged response than other topical corticosteroids. It is recommended that clobetasol have a maximum application of 60 g/week for no longer than 14 days without occlusion and that it should not be used in children below age 12.

상·하류 제품 정보

상류 원료

무수프로피온산염화 리튬

공급사100 곳

国药集团化学试剂有限公司86-21-63210123 · [email protected]
北京华美互利生物化工010-56205725 · [email protected]
梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
山东雨禾医药科技有限公司15263077727 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
南京兰亚化工贸易有限公司+86-25-8331-5620 · [email protected]
Jai Radhe Sales+(91)-(79)-26431096/65255722 · [email protected]
LGM Pharma1-(800)-881-8210 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
大连美仑生物技术有限公司0411-62910999 13889544652 · [email protected]
安耐吉化学&3A(安徽泽升科技股份有限公司)400-0056266 · [email protected]
上海诗丹德标准技术服务有限公司021-021-57127007-6622-6622 17621252073 · [email protected]
广州旺晟生物科技有限公司020-87317062 13048089691 · [email protected]
上海泰坦科技股份有限公司4006009262 13023226327 · [email protected]
MedChemexpress LLC021-58955995 · [email protected]
武汉丰泰威远科技有限公司027-87465837 19945049750 · [email protected]
武汉泽诺生物科技有限公司027-87781970 15172508891 · [email protected]
孝感深远化工有限公司15527621225; 15527621225 · [email protected]
Connect Chemicals GmbH+49 2102 2077 19 · [email protected]
斯百全化学(上海)有限公司021-021-021-67601398-809-809-809 15221380277 · [email protected]
上海源叶生物科技有限公司18916372613 · [email protected]
深圳菲斯生物科技有限公司0755-83725681-603
TOKYO CHEMICAL INDUSTRY CO., LTD.03-36680489 · [email protected]
TCI Europe320-37350700 · [email protected]
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
潍坊沃腾进出口有限公司0536-2456718
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山东博洛达生物科技有限公司0531-68651502 · [email protected]
深圳市石金谷科技有限公司(0086)755-61930359 (0086)18038192047 · [email protected]
上海将来实业股份有限公司021-61552785 · [email protected]
天津阿尔塔科技有限公司022-65378550-8551 · [email protected]
上海石洋化工有限公司021-56795766 · [email protected]
成都零六生物科技有限公司400-1166-196 13458535857 · [email protected]
雷丁试剂0510-85629785 18013409632 · [email protected]
上海御略医药科技有限公司021-60345187 13671753212 · [email protected]
上海麦克林生化科技股份有限公司15221275939 15221275939 · [email protected]
上海乾劲化工科技有限公司021-20900665 17321230821 · [email protected]
杭州杰恒化工有限公司0571-87396432 · [email protected]
上海永叶生物科技有限公司86-021-61559134 15921386130 · [email protected]
武汉励合化学新材料有限公司027-88395709
凯试(上海)科技有限公司021-50135380 · [email protected]
池州凯隆进出口贸易有限公司[email protected]
桦特昇生物科技(武汉)有限公司027-59207879 1972026995 18140587686 · [email protected]
天津阿尔塔科技有限公司022-6537-8550 15522853686 · [email protected]
Wuhan Biocar Bio-Pharm Co., Ltd.86 15387057351 · [email protected]
TargetMol中国(陶术生物)021-021-33632979 15002134094 · [email protected]
九鼎化学(上海)科技有限公司4009209199 · [email protected]
杭州鼎燕化工有限公司0571-87157530-8003 18049756717 · [email protected]

추가 설명

정의ChEBI: The 17-O-propionate ester of clobetasol. A potent corticosteroid, it is used to treat various skin disorders, including exzema and psoriasis.