기본 정보
- CAS
89464-63-1- 표준 SMILES
COC(=O)CNC(=O)C(=O)OC- InChIKey
BNJOZDZCRHCODO-UHFFFAOYSA-N- 분자식
- C6H9NO5
- 평균 분자량
- 175.14 g/mol
- 단동위원소 질량
- 175.04807239
개요
Dimethyloxalylglycine is a glycine derivative that is the diester obtained by formal condensation of the carboxy groups of N-oxalylglycine with two molecules of methanol. It has a role as an EC 1.14.11.29 (hypoxia-inducible factor-proline dioxygenase) inhibitor and a neuroprotective agent. It is a secondary carboxamide, a glycine derivative and a methyl ester. It is functionally related to a N-oxalylglycine.
이름 및 식별자
- 우선 이름
- Dimethyloxalylglycine
- IUPAC
- methyl 2-[(2-methoxy-2-oxoethyl)amino]-2-oxoacetate
- 현지명
- 디모그
- 영어명
- DMOG
- 분자식
- C6H9NO5
- 분자량
- 175.14
이름 및 동의어
dimethyloxalylglycineCHEBI:102218RefChem:813279DMOG89464-63-1DIMETHYLOXALOYLGLYCINEDimethyloxallyl glycinemethyl 2-((2-methoxy-2-oxoethyl)amino)-2-oxoacetatedimethyloxaloylglycine (dmog)methyl 2-[(2-methoxy-2-oxoethyl)amino]-2-oxoacetatemethyl n-[methoxy(oxo)acetyl]glycinateMFCD05865098
이름 더 보기
디모그OMOGOMODMOG, >=98%DMOG USP/EP/BPDimethyloxalylglycine (Dmog)
CHEMBL92309N-(methoxyoxoacetyl)-glycine, methyl esterGlycine, N-(methoxyoxoacetyl)-, methyl esterN-(2-Methoxy-2-oxoacetyl)glycine methyl esterAS-40798methyl N-(2-methoxy-2-oxoacetyl)glycinatemethyl 2-(2-methoxy-2-oxoacetamido)acetateN-[(Methoxycarbonyl)methyl]oxamic Acid Methyl Ester; N-(methoxyoxoacetyl)glycine Methyl Ester; DMOG;
데이터베이스 식별자
- CAS
89464-63-1- PubChem CID
- 560326
- DTXSID
DTXSID80339961
물성
구조 계산 물성
- XLogP
- -0.3
- 극성 표면적
- 81.7 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 5
- 무거운 원자 수
- 12
- 형식 전하
- 0
- 복잡도
- 200
물리화학적 성질
- 녹는점
- 46 · 46-48°C
- 끓는 점
- 179 · 179-182 °C(Press: 12 Torr)
- 밀도
- 1.246 · 1.246±0.06 g/cm3(Predicted)
- 저장 조건
- -20 °C · -20°C
- 용해도
- 2 O: · H2O: >30mg/mL
- 산도 계수 (pKa)
- 10.55 · 10.55±0.46(Predicted)
- 물리적 상태
- 고체
- 색상
- 흰색에서 황백색까지
- 수용성
- 30 mg/ml의 · 30mg/ml의 물에 용해됩니다.
- 안정성
- 1 · 솔루션이 불안정합니다.현장에서 준비하여 영업일 기준 1일 이내에 사용해야 합니다.
- InChI
- InChI=1S/C6H9NO5/c1-11-4(8)3-7-5(9)6(10)12-2/h3H2,1-2H3,(H,7,9)
- InChIKey
- BNJOZDZCRHCODO-UHFFFAOYSA-N
- SMILES
- C(OC)(=O)CNC(C(OC)=O)=O
화학적 성질
Off-White to Pale Pink Solid
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 4 (100%)
안전 데이터
- wgk
- 3
- HS 번호
- 2924.19.8000
- risk_code
- 22
- hazard_code
- Xi,Xn
- 위험 등급
- IRRITANT
- Hazard Classifications
- Acute Tox. 4 Oral
- 스토리지 클래스
- 11 - Combustible Solids
화학 및 산업
응용 분야
개요The pro-angiogenic factor HIF-1α is targeted for destruction in normoxic environments by the hydroxylation of a specific proline residue, P564, by the oxygen-sensing enzyme HIF-1α prolyl hydroxylase (HIF-PH). DMOG is a cell permeable, competitive inhibitor of HIF-PH. It acts to stabilize HIF-1α expression at normal oxygen tensions in cultured cells, at concentrations between 0.1 and 1 mM. DMOG is therefore expected to act as a pro-angiogenic compound, acting via the HIF-1α system.
용도DMOG is a cell permeable prolyl-4-hydroxylase inhibitor which upregulates HIF activity. HIF activation stimulates angiogenesis in several different models (1nM). DMOG also inhibits FIH (factor inhibiting HIF), an asparaginyl hydroxylase, which enhances the HIF response. It is active in vivo and attenuates myocardial injury in a rabbit ischemia reperfusion model (20mg/Kg).
상·하류 제품 정보
상류 원료
하류 제품
공급사100 곳
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
湖南韵邦生物科技股份有限公司0731-88532326 13319508186 · [email protected]
南通飞宇生物科技有限公司0513-68819626 15152877458 · [email protected]
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