기본 정보
- CAS
79902-62-8- 표준 SMILES
CCC(C)(C)C(=O)O[C@@H]1C[C@H](C)C=C2C=C[C@@H](C)[C@@H](CC[C@@H]3C[C@H](O)CC(=O)O3)[C@@H]21- InChIKey
RYMZZMVNJRMUDD-MKPQAFFTSA-N- 분자식
- C25H38O5
- 평균 분자량
- 418.6 g/mol
- 단동위원소 질량
- 418.27192431
이름 및 식별자
- 우선 이름
- Dihydro-Simvastatin
- IUPAC
- [(1R,3S,7R,8R,8aS)-8-[2-[(2R,4S)-4-hydroxy-6-oxooxan-2-yl]ethyl]-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl] 2,2-dimethylbutanoate
- 현지명
- 심바스타틴EP불순물G
- 영어명
- SiMvastatin EP IMpurity G
- 분자식
- C26H38O5
- 분자량
- 430.58
이름 및 동의어
Dihydro-Simvastatin92083-03-9Simvastatin Impurity 1SCHEMBL2472AKOS015920204CS-0166511Simvastatin Impurity 8; Pravastatin Impurity 1Simvastatin EP Impurity K (Simvastatin Impurity(1R,3S,7R,8R,8aS)-8-(2-((2R,4S)-4-hydroxy-6-oxotetrahydro-2H-pyran-2-yl)ethyl)-3,7-dimethyl-1,2,3,7,8,8a-hexahydronaphthalen-1-yl 2,2-dimethylbutanoate심바스타틴EP불순물GSimvastatin-3-enSimvastatin impurity 7
이름 더 보기
Simvastatin Impurity 193-Methylene Simvastatin3-Methylene Simvastatin Impurity3-Butenoic acid, 2,2,3-trimethyl-, 1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl ester, [1S-[1α,3α,7β,8β(2S*,4S*),8aβ]]- (9CI)[1S-[1alpha,3alpha,7beta,8beta(2S*,4S*),8abeta]]-2,2,3-Trimethyl-3-butenoic acid 1,2,3,7,8,8a-hexahydro-3,7-dimethyl-8-[2-(tetrahydro-4-hydroxy-6-oxo-2H-pyran-2-yl)ethyl]-1-naphthalenyl esterSimvastatin EP Impurity GQ: What is Simvastatin EP Impurity G Q: What is the CAS Number of Simvastatin EP Impurity G Q: What is the storage condition of Simvastatin EP Impurity G Q: What are the applications of Simvastatin EP Impurity G
물성
구조 계산 물성
- XLogP
- 4.7
- 극성 표면적
- 72.8 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 5
- 회전 가능 결합 수
- 7
- 무거운 원자 수
- 30
- 형식 전하
- 0
- 복잡도
- 706
물리화학적 성질
- 끓는 점
- 579.7 · 579.7±50.0 °C(Predicted)
- 밀도
- 1.11 · 1.11±0.1 g/cm3(Predicted)
- 산도 계수 (pKa)
- 13.49 · 13.49±0.40(Predicted)
화학 및 산업
응용 분야
용도3-Methylene Simvastatin is the impurity of Simvastatin (S485000), a synthetic derivate of a fermentation product of Aspergillus terreus. Simvastatin is a competitive inhibitor of HMG-CoA reductase and is the synthetic analog of Lavostatin, an antilipemic agent.
공급사21 곳
怀化元研达生物技术有限责任公司18711085600 · [email protected]
Sinco Pharmachem (ShenZhen) R&D Co., Ltd.+86-18603013401 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
孟成科技（上海）有限公司400-820-6829 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
怀化元研达生物技术有限责任公司18711085600; 18229999901 · [email protected]
深圳菲斯生物科技有限公司0755-83725681-603
深圳振强药物研发有限公司0755-66853366 13670046396 · [email protected]
惠州拓康生物科技有限公司+86 (0752) 222-7171, +86 15815821171
常州翔龙医药科技有限公司18915873328 18915873328 · [email protected]
南京熙泽医药科技有限公司025-66023220 15250997978 · [email protected]
관련 반응
0건
현재 필터 조건에 해당하는 반응 기록이 없습니다.
화합물 노트
불러오는 중…