기본 정보
- CAS
751-84-8- 표준 SMILES
CC1(C)S[C@@H]2[C@H](NC(=O)Cc3ccccc3)C(=O)N2[C@H]1C(=O)O.c1ccc(CCNCc2ccccc2)cc1- InChIKey
JAQPGQYDZJZOIN-LQDWTQKMSA-N- 분자식
- C31H35N3O4S
- 평균 분자량
- 545.7 g/mol
- 단동위원소 질량
- 545.23482778
개요
Benethamine Penicillin is the benethamine salt of penicillin G, a member of the penicillin antibiotic family with broad-spectrum bactericidal activity. Penicillin G binds to and inactivates penicillin-binding proteins (PBPs), enzymes located on the inner membrane of the bacterial cell wall, resulting in the weakening of the bacterial cell wall and cell lysis. PBPs participate in the terminal stages of assembling the bacterial cell wall, and in reshaping the cell wall during cell division. Inactivation of PBPs interferes with the cross-linkage of peptidoglycan chains necessary for bacterial cell wall strength and rigidity.
이름 및 식별자
- 우선 이름
- Benethamine Penicillin
- IUPAC
- N-benzyl-2-phenylethanamine;(2S,5R,6R)-3,3-dimethyl-7-oxo-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
- 현지명
- 베네타민페니실린
- 영어명
- benethamine penicillin
- 분자식
- C16H18N2O4S.C15H17N
- 분자량
- 545.701
이름 및 동의어
Benethamine penicillinBenetacil751-84-8Benethamine penicillin GPenicillin G benethamineO3S7RWT8R5Benzylpenicillin salt of N-benzylphenethylamineDTXSID10226072TriplopenRefChem:116984DTXCID10148563212-029-8
이름 더 보기
베네타민페니실린BENETHAMINE-PENICLLINBenzylpenicillin BenethamineBENETHAMINE PENICILLIN USP/EP/BP2-phenyl-N-(phenylmethyl)ethanamine(2S,5R,6R)-3,3-dimethyl-7-oxo-6-(2-phenylethanoylamino)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid(2S,5R,6R)-7-keto-3,3-dimethyl-6-[(2-phenylacetyl)amino]-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid4-Thia-1-azabicyclo3.2.0heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-(phenylacetyl)amino- (2S,5R,6R)-, compd. with N-(phenylmethyl)benzeneethanamine (1:1)
4-Thia-1-azabicyclo(3.2.0)heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-((phenylacetyl)amino)-(2S-(2-alpha,5-alpha,6-beta))-, compd. with N-(phenylmethyl)benzeneethanamine (1:1)CHEBI:52151penicilina-benetaminaBenethamine penicillineBenapenBenetolinBetapenPenicillinbenethaminum
물성
구조 계산 물성
- 극성 표면적
- 124 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 9
- 무거운 원자 수
- 39
- 형식 전하
- 0
- 복잡도
- 696
실험 및 물리화학적 성질
Animal DrugsPharmaceuticals -> UK Veterinary Medicines Directorate List
물리화학적 성질
- 녹는점
- 146 · 146-147°
- 밀도
- 1.0996 · 1.0996 (rough estimate)
- 굴절률
- 1.632 · 1.6320 (estimate)
- 색상
- 크리스탈
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
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, P319, P321, P333+P317, P342+P316, P362+P364, P403, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 56 reports by companies from 3 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
유해성 정보
Regulatory InformationPenicillin benethamine: 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 - 4-Thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid, 3,3-dimethyl-7-oxo-6-[(phenylacetyl)amino]-, [2S-(2.alpha.,5.alpha.,6.beta.)]-, compound with N-(phenylmethyl)benzeneethanamine (1:1): Environment tier I assessment
Hazard Classes and CategoriesSkin Sens. 1 (100%)
안전 데이터
- 독성
- LD50 ivn-rat: 122 mg/kg ANTCAO 5, 152,55
화학 및 산업
약리 정보
ATC CodeQJ - Antiinfectives for systemic use
공급사2 곳
WATERSTONE[email protected]
宝欧信特生物科技（苏州）有限公司51288865780 · [email protected]
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