기본 정보
- CAS
136112-01-1- 표준 SMILES
CCC(=O)O[C@]1(C(=O)SCF)[C@H](C)C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)C3(F)[C@@H](O)C[C@@]21C.OCc1cc(C(O)CNCCCCCCOCCCCc2ccccc2)ccc1O- InChIKey
YYAZJTUGSQOFHG-IAVNQIGZSA-N- 분자식
- C50H68F3NO9S
- 평균 분자량
- 916.1 g/mol
- 단동위원소 질량
- 915.45668841
개요
See also: Fluticasone Propionate (has component); Salmeterol Xinafoate (has component).
이름 및 식별자
- 우선 이름
- Fluticasone propionate; salmeterol xinafoate
- IUPAC
- [(6S,8S,10S,11S,13S,14S,16R,17R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate;2-(hydroxymethyl)-4-[1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]phenol
- 영어명
- 2-(hydroxymethyl)-4-[1-hydroxy-2-[6-(4-phenylbutoxy)hexylamino]ethyl]phenol
- 분자식
- C50H68F3NO9S
- 분자량
- 0
이름 및 동의어
AirDuo RespiClickAdvair Diskus 100/50Advair Diskus 250/50Advair Diskus 500/50Fluticasone propionate and salmeterol xinafoateWixela InhubAirDuo DigihalerADVAIRDISKUSRefChem:55223Fluticasone Propionate and SalmeterolFluticasone Propionate and Salmeterol HFAFluticasone propionate/salmeterol xinafoate
이름 더 보기
Advair DiskusAdoairAdoair DiskusFlutide DiskusSeretide AccuhalerSalMeterol-fluticasone propionate Mixt.SalMeterol Fluticasone Propionate Mixture[(6S,8S,10S,11S,13S,14S,16R)-6,9-difluoro-17-(fluoromethylsulfanylcarbonyl)-11-hydroxy-10,13,16-trimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl] propanoate(6α,11β,16α,17α)-6,9-Difluoro-11-hydroxy-16-Methyl-3-oxo-17-(1-oxopropoxy)androsta-1,4-diene-17-carbothioic Acid S-(FluoroMethyl) Ester Mixture with 4-Hydroxy-α1-[[[6-(4-phenylbutoxy)hexyl]aMino]Methyl]-1,3-benzenediMethanol
물성
구조 계산 물성
- 극성 표면적
- 188 Ų
- 수소 결합 공여자 수
- 5
- 수소 결합 수용자 수
- 14
- 회전 가능 결합 수
- 22
- 무거운 원자 수
- 64
- 형식 전하
- 0
- 복잡도
- 1,390
실험 및 물리화학적 성질
Human Drugs
EMA approved medicines: Human medicine
FDA approved drugs -> Active ingredient
물리화학적 성질
- InChI
- InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2
- InChIKey
- GIIZNNXWQWCKIB-UHFFFAOYSA-N
- SMILES
- C1(O)=CC=C(C(O)CNCCCCCCOCCCCC2=CC=CC=C2)C=C1CO
화학 및 산업
응용 분야
용도Salmeterol-fluticasone combination as Adoair, dry powder inhlaler/pressured metered-dose inhaler formulation for bronchial asthma, its benefit or demerits as device for inhalation drug delivery system in pharmacokinetics/pharmacodynamics at lung or peripheral bronchi, indications and usage of aerochamber, and clinical efficacy and safety in asthma control.
공급사5 곳
凯试(上海)科技有限公司021-50135380 · [email protected]
北京百奥创新科技有限公司15522676233 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
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