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Flunixin Meglumine

HCID 39212
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기본 정보개요이름 및 식별자물성안전 및 규제화학 및 산업관련 반응화합물 노트
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기본 정보

CAS
42461-84-7
표준 SMILES
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.Cc1c(Nc2ncccc2C(=O)O)cccc1C(F)(F)F
InChIKey
MGCCHNLNRBULBU-WZTVWXICSA-N
분자식
C21H28F3N3O7
평균 분자량
491.5 g/mol

개요

Flunixin meglumine is an organoammonium salt obtained by combining flunixin with one molar equivalent of 1-deoxy-1-(methylamino)-D-glucitol. A relatively potent non-narcotic, nonsteroidal analgesic with anti-inflammatory, anti-endotoxic and anti-pyretic properties; used in veterinary medicine for treatment of horses, cattle and pigs. It has a role as a non-steroidal anti-inflammatory drug, a non-narcotic analgesic, an antipyretic and an EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor. It contains a flunixin(1-).

이름 및 식별자

우선 이름
Flunixin Meglumine
IUPAC
(2R,3R,4R,5S)-6-(methylamino)hexane-1,2,3,4,5-pentol;2-[2-methyl-3-(trifluoromethyl)anilino]pyridine-3-carboxylic acid
영어명
Flunixin Meglumin
분자식
C14H11F3N2O2.C7H17NO5
분자량
491.46

이름 및 동의어

FLUNIXIN MEGLUMINE42461-84-7BanamineFlumeglumineSch 14714 meglumineFlunixin-SFlunixin N-methylglucanineSch-14714 meglumine8Y3JK0JW3UFlunixin meglumine saltFlunazineNSC-759583
이름 더 보기
flunixin megluminFlunixin Meglunine1-deoxy-1-(methylamino)-d-glucito2-((2-methyl-3-(trifluoromethyl)phenyl)amFinadyneEquileveNIH 10250fluixi egluieIliuM Flunixil
CHEBI:761442-((2-Methyl-3-(trifluoromethyl)-phenyl)amino)-3-pyridinecarboxylic acid with meglumine compoundedDTXCID9025584FlunineVetaMegBanamine PasteFlunazine-SVetameg S

데이터베이스 식별자

CAS
42461-84-7
PubChem CID
39212
ChEMBL
CHEMBL1733447
ChEBI

물성

구조 계산 물성

극성 표면적
175 Ų
수소 결합 공여자 수
8
수소 결합 수용자 수
13
회전 가능 결합 수
9
무거운 원자 수
34
형식 전하
0
복잡도
510

실험 및 물리화학적 성질

DrugsDEA NFLIS-Drug Category -> Analgesics
Animal DrugsActive Ingredients (Flunixin Meglumine) -> FDA Greenbook

물리화학적 성질

녹는점
136.6 · 136.6-137.4 °C
저장 조건
room temp
용해도
2 O: · H2O: 자유롭게 용해됨
물리적 상태
고체
색상
회백색
수용성
녹는
InChIKey
MGCCHNLNRBULBU-WZTVWXICSA-N
SMILES
CNC[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO.Cc1c(Nc2ncccc2C(O)=O)cccc1C(F)(F)F

화학적 성질

White Solid

안전 및 규제

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

GHS 분류

GHS Classification · 5건

This chemical does not meet GHS hazard criteria for 0.5% (1 of 215) of reports.

Danger

H301 (79.5%): Toxic if swallowed [Danger Acute toxicity, oral]

P260, P261, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P320, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 215 reports by companies from 21 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

유해성 정보

Regulatory InformationFlunixin meglumine: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Other Safety InformationIMAP assessments - D-Glucitol, 1-deoxy-1-(methylamino)-, 2-[[2-methyl-3-(trifluoromethyl)phenyl]amino]-3-pyridinecarboxylate (salt): Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 3 (79.5%)

안전 데이터

wgk
3
rtecs
LZ4367000
ridadr
UN 2811 6.1 / PGI
HS 번호
29339900
risk_code
36/37/38
hazard_code
Xi
safety_code
26-36
Hazard Classifications
Eye Irrit. 2Skin Irrit. 2STOT SE 3
스토리지 클래스

화학 및 산업

약리 정보

MeSH Pharmacological Classification · 2건

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects.

Drugs that are used to reduce body temperature in fever.

용도 및 제조

Use ClassificationAnimal Drugs -> FDA Approved Animal Drug Products (Green Book) -> Active Ingredients
응용 분야 · 2건

용도Flunixin meglumine has been used as a nonsteroidal anti-inflammatory drug standard in electrospray ionization mass spectrometry (LC-ESI/MS).

일반 설명Flunixin meglumine is a nonsteroidal anti-inflammatory drug and a potent cyclo-oxygenase (COX) inhibitor. It is commonly used as an analgesic and antipyretic in animals.Pharmaceutical secondary standards for application in quality control, provide pharma laboratories and manufacturers with a convenient and cost-effective alternative to the preparation of in-house working standards.

추가 설명 · 1건

정의ChEBI: An organoammonium salt obtained by combining flunixin with one molar equivalent of 1-deoxy-1-(methylamino)-D-glucitol. A relatively potent non-narcotic, nonsteroidal analgesic with anti-inflammatory, anti-endotoxic and anti-pyretic propert es; used in veterinary medicine for treatment of horses, cattle and pigs.

관련 반응

9건
반응 기록 만들기
HRID 1006517 반응식
HRID 1006517반응물로uspto-grants-2004_09
HRID 1006518 반응식
HRID 1006518반응물로uspto-grants-2004_09
HRID 1006519 반응식
HRID 1006519반응물로uspto-grants-2004_09
HRID 1666772 반응식
HRID 1666772반응물로uspto-grants-2011_10
HRID 1666773 반응식
HRID 1666773반응물로uspto-grants-2011_10
HRID 1666774 반응식
HRID 1666774반응물로uspto-grants-2011_10
HRID 1888132 반응식
HRID 1888132반응물로uspto-grants-2013_08
HRID 1888133 반응식
HRID 1888133반응물로uspto-grants-2013_08
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CHEBI:76144
UNII
8Y3JK0JW3U
EC Number
255-836-0
11 - Combustible Solids