기본 정보
- CAS
59995-64-1- 표준 SMILES
C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(SCCN)C[C@H]12- InChIKey
WKDDRNSBRWANNC-ATRFCDNQSA-N- 분자식
- C11H16N2O4S
- 평균 분자량
- 272.32 g/mol
- 단동위원소 질량
- 272.08307817
개요
Thienamycin is a member of carbapenems.
이름 및 식별자
- 우선 이름
- (+)-Thienamycin
- IUPAC
- (5R,6S)-3-(2-aminoethylsulfanyl)-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
- 영어명
- Thienamycin
- 분자식
- C11H16N2O4S
- 분자량
- 272.32
이름 및 동의어
Thienamycin59995-64-1(+)-ThienamycinWMW5I5964P(5R,6S)-3-(2-aminoethylsulfanyl)-6-[(1R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acidDTXSID10975412(5R,6S)-3-(2-aminoethylsulfanyl)-6-((1R)-1-hydroxyethyl)-7-oxo-1-azabicyclo(3.2.0)hept-2-ene-2-carboxylic acidRefChem:905484DTXCID1014028141-Azabicyclo(3.2.0)hept-2-ene-2-carboxylic acid, 3-((2-aminoethyl)thio)-6-(1-hydroxyethyl)-7-oxo-,(5R,6S)-3-(2-azaniumylethylsulfanyl)-6-((1R)-1-hydroxyethyl)-7-oxo-1-azabicyclo(3.2.0)hept-2-ene-2-carboxylateTienamycin
이름 더 보기
Thienamycin USP/EP/BPImipenemum Impurity A(3As,7As)-Octahydro-2-benzofuranImipenem Impurity 1(Imipenem EP Impurity A)(5R)-3-(2-Aminoethylthio)-6β-[(R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hepta-2-ene-2-carboxylic acid(5R)-3-[(2-Aminoethyl)thio]-6β-[(R)-1-hydroxyethyl]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
(+/-)-ThienamycinImipenem EP Impurity AThienamycin, (+/-)-Thienamycin (>80%)UNII-EWR2GDB37HEWR2GDB37HImipenem Impurity A(5R,6S)-3-((2-aminoethyl)thio)-6-((R)-1-hydroxyethyl)-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
물성
구조 계산 물성
- XLogP
- -3
- 극성 표면적
- 129 Ų
- 수소 결합 공여자 수
- 3
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 18
- 형식 전하
- 0
- 복잡도
- 423
물리화학적 성질
- 끓는 점
- 514 · 514.0±50.0 °C(Predicted)
- 밀도
- 1.5 · 1.50±0.1 g/cm3(Predicted)
- 저장 조건
- -86 °C · Hygroscopic, -86°C Freezer, Under inert atmosphere
- 용해도
- 클로로포름(약간 용해됨), 메탄올(약간 용해됨), 물(약간 용해됨)
- 물리적 상태
- 고체
- 산도 계수 (pKa)
- 4.2 · 4.20±0.40(Predicted)
- 색상
- 미색에서 진한 노란색까지
- 안정성
- 흡습성, 온도에 민감하고 매우 불안정함
- InChI
- InChI=1S/C11H16N2O4S/c1-5(14)8-6-4-7(18-3-2-12)9(11(16)17)13(6)10(8)15/h5-6,8,14H,2-4,12H2,1H3,(H,16,17)/t5-,6-,8-/m1/s1
- InChIKey
- WKDDRNSBRWANNC-ATRFCDNQSA-N
- SMILES
- N12[C@@]([H])([C@@H]([C@H](O)C)C1=O)CC(SCCN)=C2C(O)=O
화학 및 산업
약리 정보
MeSH Pharmacological ClassificationSubstances that inhibit the growth or reproduction of BACTERIA.
응용 분야
개요Thienamycin, one of the most potent naturally-produced antibiotics known thus far, was discovered in Streptomyces cattleya in 1976. Thienamycin has excellent activity against both Gram-positive and Gram-negative bacteria and is resistant to bacterial β-lactamase enzymes.
용도Thienamycin is one of the most potent naturally produced antibiotics known thus far. It has excellent activity against both Gram-positive and Gram-negative bacteria and is resistant to bacterial β-lactamase enzymes.
상·하류 제품 정보
상류 원료
공급사64 곳
济南百隆化学有限公司[email protected] · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
武汉敬康恩生物医药科技有限公司
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