Myxothiazol
Grundinformationen
- CAS
76706-55-3- Standard-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- Summenformel
- C25H33N3O3S2
- Durchschnittliche Molmasse
- 487,7 g/mol
- Monoisotopische Masse
- 487,19633392
Überblick
Thenoyltrifluoroacetone is an organic molecular entity. It has a role as a chelator and an EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor.
Namen und Bezeichner
- Bevorzugter Name
- 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
- Lokaler Name
- Myxothiazol
- Englischer Name
- MYXOTHIAZOL
- Summenformel
- C25H33N3O3S2
- Molmasse
- 487.68
Namen und Synonyme
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
Weitere Namen anzeigen
Myxothiazo5-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
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,8
- Polarare Oberfläche (TPSA)
- 144 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 7
- Frei drehbare Bindungen
- 12
- Schwere Atome
- 33
- Formalladung
- 0
- Komplexität
- 738
Experimentelle und physikochemische Eigenschaften
DrugsPharmaceuticals -> Antibiotics
Physikochemische Eigenschaften
- Siedepunkt
- 679.6 · 679.6±65.0 °C(Predicted)
- Dichte
- 1.158 · 1.158±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · -20°C
- Löslichkeit
- 9.8 · chloroform: soluble9.80 - 10.20mg/mL, clear, colorless to yellow
- Aggregatzustand
- Solid
- pka
- 14.07 · 14.07±0.50(Predicted)
- Farbe
- White to off-white
- Biologische Quelle
- 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
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
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.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 2 (100%)
Sicherheitsdaten
- F
- 10
- wgk
- 3
- ridadr
- UN 3462 6.1/PG 1
- RTECS-Nr.
- QH7580000
- risk_code
- 28
- hazard_code
- T+
- safety_code
- 28-36/37-45
- hazard_class
- 6.1(b)
- packing_group
- III
- Speicherklasse
- 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials
- Hazard Classifications
- Acute Tox. 2 Oral
Chemie und Industrie
Pharmakologische Informationen
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.
Anwendungen
VerwendenMyxothiazol 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.
Anbieter21 Anbieter
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]
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