기본 정보
- CAS
76706-55-3- 표준 SMILES
CO/C(=C/C(N)=O)[C@H](C)[C@H](/C=C/c1csc(-c2csc([C@@H](C)/C=C/C=C/C(C)C)n2)n1)OC- InChIKey
XKTFQMCPGMTBMD-FYHMSGCOSA-N- 분자식
- C25H33N3O3S2
- 평균 분자량
- 487.7 g/mol
- 단동위원소 질량
- 487.19633392
개요
Thenoyltrifluoroacetone is an organic molecular entity. It has a role as a chelator and an EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor.
이름 및 식별자
- 우선 이름
- Myxothiazol
- IUPAC
- (2E,4R,5S,6E)-3,5-dimethoxy-4-methyl-7-[2-[2-[(2S,3E,5E)-7-methylocta-3,5-dien-2-yl]-1,3-thiazol-4-yl]-1,3-thiazol-4-yl]hepta-2,6-dienamide
- 현지명
- 믹소티아졸
- 영어명
- MYXOTHIAZOL
- 분자식
- C25H33N3O3S2
- 분자량
- 487.68
이름 및 동의어
Myxothiazol76706-55-3Myxothiazol A6VY98BQ7NB(+)-MYXOTHIAZOL A2,6-Heptadienamide, 7-(2'-((1S,2E,4E)-1,6-dimethyl-2,4-heptadienyl)(2,4'-bithiazol)-4-yl)-3,5-dimethoxy-4-methyl-, (2E,4R,5S,6E)-2,6-Heptadienamide, 7-(2'-(1,6-dimethyl-2,4-heptadienyl)(2,4'-bithiazol)-4-yl)-3,5-dimethoxy-4-methyl-DTXSID10868411(2E,4R,5S,6E)-3,5-dimethoxy-4-methyl-7-[2-[2-[(2S,3E,5E)-7-methylocta-3,5-dien-2-yl]-1,3-thiazol-4-yl]-1,3-thiazol-4-yl]hepta-2,6-dienamideCHEBI:25461(2E,4R,5S,6E)-3,5-dimethoxy-4-methyl-7-(2-(2-((2S,3E,5E)-7-methylocta-3,5-dien-2-yl)-1,3-thiazol-4-yl)-1,3-thiazol-4-yl)hepta-2,6-dienamideRefChem:160528
이름 더 보기
믹소티아졸Myxothiazo5-dimethoxy-4-methyl-myxothiazolfrommyxobacteriumMYXOTHIAZOL, VIAL WITH 10 MG*MYXOTHIAZOL FROM MYXOBACTERIUM 95%MYXOTHIAZOL, FROM MYXOCOCCUS FULVUSmyxothiazol from myxobacterium*myxococcus fulvus7-(2’-(1,6-dimethyl-2,4-heptadienyl)(2,4’-bithiazol)-4-yl)-6-heptadienamide
물성
구조 계산 물성
- XLogP
- 4.8
- 극성 표면적
- 144 Ų
- 수소 결합 공여자 수
- 1
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 33
- 형식 전하
- 0
- 복잡도
- 738
실험 및 물리화학적 성질
DrugsPharmaceuticals -> Antibiotics
물리화학적 성질
- 끓는 점
- 679.6 · 679.6±65.0 °C(Predicted)
- 밀도
- 1.158 · 1.158±0.06 g/cm3(Predicted)
- 저장 조건
- -20 °C · -20°C
- 용해도
- 9.8 · 클로로포름: 용해성9.80 - 10.20mg/mL, 투명, 무색~노란색
- 물리적 상태
- Solid
- 산도 계수 (pKa)
- 14.07 · 14.07±0.50(Predicted)
- 색상
- White to off-white
- 생물학적 소스
- 85 · Myxococcus fulvus Mx f85
- InChIKey
- XKTFQMCPGMTBMD-ZDBABOMLSA-N
- SMILES
- CO[C@@H](\C=C\c1csc(n1)-c2csc(n2)[C@@H](C)\C=C\C=C\C(C)C)[C@@H](C)\C(OC)=C\C(N)=O
안전 및 규제
안전 정보는 참고용이며, 공급업체의 물질안전보건자료(SDS), 관련 법규 및 전문가 평가를 대체하지 않습니다.
GHS 분류
GHS Classification
Danger
H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
유해성 정보
Hazard Classes and CategoriesAcute Tox. 2 (100%)
안전 데이터
- wgk
- 3
- rtecs
- QH7580000
- ridadr
- UN 3462 6.1/PG 1
- risk_code
- 28
- hazard_code
- T+
- safety_code
- 28-36/37-45
- 포장분류
- III
- 위험 등급
- 6.1(b)
- F 고인화성물질
- 10
- Hazard Classifications
- Acute Tox. 2 Oral
- 스토리지 클래스
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
화학 및 산업
약리 정보
MeSH Pharmacological Classification
Substances that destroy fungi by suppressing their ability to grow or reproduce. They differ from FUNGICIDES, INDUSTRIAL because they defend against fungi present in human or animal tissues.
Compounds or agents that combine with an enzyme in such a manner as to prevent the normal substrate-enzyme combination and the catalytic reaction.
응용 분야
용도Myxothiazol has been used in as a mitochondrial electron transport chain (mETC) inhibitor in P19 murine embryonal carcinoma pluripotent cell line and to treat HeLa cells for integrated stress response activation.
공급사21 곳
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
武汉易泰科技有限公司上海分公司18930552037 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318593351 · [email protected]
United Life Science020-82099279 18988968278 · [email protected]
怀化市冰峰化工有限公司0745-2866851 17711757908 · [email protected]
銳迪國際科技有限公司18024082417 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
上海麦克林生化科技股份有限公司
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