기본 정보
- 표준 SMILES
COCC1=C(C(=O)OC(C)OC(=O)OC(C)C)N2C(=O)[C@@H](NC(=O)/C(=N\OC)c3csc(N)n3)[C@H]2SC1- InChIKey
LTINZAODLRIQIX-FBXRGJNPSA-N- 분자식
- C21H27N5O9S2
- 평균 분자량
- 557.6 g/mol
- 단동위원소 질량
- 557.12501944
개요
Cefpodoxime proxetil is the 1-[(isopropoxycarbonyl)oxy]ethyl (proxetil) ester prodrug of cefpodoxime. After swallowing, hydrolysis of the ester group occurs in the intestinal epithelium, to release active cefpodoxime in the bloodstream. It is used to treat acute otitis media, pharyngitis, and sinusitis. It has a role as an antibacterial drug and a prodrug. It is a cephalosporin, a carboxylic ester and a carboxylic acid. It is functionally related to a cefpodoxime and a 4-{((R)-2-Carboxy-3-methoxymethyl-8-oxo-5-thia-1-aza-bicyclo[4.2.0]oct-2-en-7-ylcarbamoyl)-[(Z)-methoxyimino]-methyl}-thiazol-2-yl-ammonium.
이름 및 식별자
- 우선 이름
- Cefpodoxime Proxetil
- IUPAC
- 1-propan-2-yloxycarbonyloxyethyl (6R,7R)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyiminoacetyl]amino]-3-(methoxymethyl)-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
이름 및 동의어
cefpodoxime proxetil87239-81-4VantinBananOreloxOtreonCS-807CefodoxSimplicefPodomexefU-76252DTXSID1022766
이름 더 보기
2TB00A1Z7NCHEBI:3505NSC-759161DTXCID802766(RS)-1-((Isopropoxycarbonyl)oxy)ethyl (+)-(6R,7R)-7-(2-(2-amino-4-thiazolyl)-2-((Z)-methoxyimino)acetamido)-3-(methoxymethyl)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylatecephalosporin 807Proxetil, Cefpodoxime807, Cephalosporin
데이터베이스 식별자
- CAS
87239-81-4- PubChem CID
- 6526396
- DTXSID
DTXSID1022766- ChEMBL
CHEMBL1201016- ChEBI
CHEBI:3505- UNII
- 2TB00A1Z7N
- EC Number
- 688-311-3、918-886-0
- Nikkaji
- J227.713A
물성
구조 계산 물성
- XLogP
- 0.6
- 극성 표면적
- 235 Ų
- 수소 결합 공여자 수
- 2
- 수소 결합 수용자 수
- 14
- 회전 가능 결합 수
- 13
- 무거운 원자 수
- 37
- 형식 전하
- 0
- 복잡도
- 976
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Antibiotics
LogP1.7
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Animal DrugsFDA approved animal drugs -> Active ingredient
안전 및 규제
GHS 분류
GHS Classification
Danger
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P233, P260, P261, P271, P272, P280, P284, P302+P352, P304+P340, P321, P333+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 10 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Danger
H317 (50%): May cause an allergic skin reaction [Warning Sensitization, Skin]
유해성 정보
Hazard Classes and Categories
Skin Sens. 1 (50%)
Skin Sens. 1 (100%)
독성 정보
Drug Induced Liver Injury
Drug Induced Liver Injury Rank (DILIrank 2.0)
Cefpodoxime proxetil
Ambiguous-DILI-concern
3
Adverse reactions
DOI:10.1016/j.drudis.2016.02.015
화학 및 산업
약리 정보
FDA Pharmacological Classification
CEFPODOXIME PROXETIL
Cephalosporin Antibacterial [EPC]; Cephalosporins [CS]
MeSH Pharmacological ClassificationBactericidal agents that contain a beta-lactam ring in their chemical structure. They inhibit bacterial cell wall synthesis by binding to PENICILLIN-BINDING PROTEINS, preventing the synthesis of peptidoglycan in bacterial cell walls.
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