D-Alpha-Tocopherylquinone 托可醌
CAS 7559-04-8 MFCD00135657
化学结构图
SMILES: CC(C)CCC[C@@H](C)CCC[C@@H](C)CCC[C@@](C)(O)CCC1C(=O)C(C)=C(C)C(=O)C=1C
化学属性
| Mol. Formula | C29H50O3 |
|---|---|
| Mol. Weight | 446.72 |
| Refractive index | 1.4960 to 1.5000 |
别名和识别编码
| Chemical Name | D-Alpha-Tocopherylquinone |
|---|---|
| MDL Number | |
| CAS Number | 7559-04-8 |
| Synonym | alpha-Tocoquinone alpha-Tocopheroquinone Metarene alpha-Tocopheryl-quinone Tocopherylquinone D-alpha-Tocopherylquinone ATQ alpha-Tocopherol quinone |
| EC Number | 231-450-8 |
| Chemical Name Translation | 托可醌 |
| Reaxys-RN | 1916833 |
| PubChem Substance ID | 2734086 |
| Wiswesser Line Notation | L6V DVJ B2XQ1&3Y1&3Y1&3Y1&1 C1 E1 F1 |
| InChI | InChI=1S/C29H50O3/c1-20(2)12-9-13-21(3)14-10-15-22(4)16-11-18-29(8,32)19-17-26-25(7)27(30)23(5)24(6)28(26)31/h20-22,32H,9-19H2,1-8H3/t21-,22-,29-/m1/s1 |
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分类
- {SNA} Alcohols, Building Blocks, C11 to C30+, C15 to C38, Carbonyl Compounds, Chemical Synthesis, Ketones, Organic Building Blocks, Oxygen Compounds
相关文献及参考
安全信息
TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE : 1980 mg/kg SEX/DURATION : female 7-15 day(s) after conception TOXIC EFFECTS : Reproductive - Fertility - litter size (e.g. # fetuses per litter; measured before birth) REFERENCE : THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 30,767,1975
TYPE OF TEST : TDLo - Lowest published toxic dose ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE : 675 mg/kg SEX/DURATION : female 7-15 day(s) after conception TOXIC EFFECTS : Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants) REFERENCE : THERAP Therapie. (Doin, Editeurs, 8, Place de l'Odeon, F-75006 Paris, France) V.1- 1946- Volume(issue)/page/year: 30,767,1975
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