478-29-5 (9,10-蒽二酮，1,2,5-三羟基-6-甲基-,9,10-Anthracenedione,1,2,5-trihydroxy-6-methyl-)

快速询单

结构式：

9,10-蒽二酮，1,2,5-三羟基-6-甲基-MOL文件

CAS号：

478-29-5

中文名称：

9,10-蒽二酮，1,2,5-三羟基-6-甲基-

英文名称：

9,10-Anthracenedione,1,2,5-trihydroxy-6-methyl-

分子式：

C₁₅H₁₀O₅

分子量：

270.236904621124

植物源：

臭叶木新乌檀臭叶木

9,10-蒽二酮，1,2,5-三羟基-6-甲基-(478-29-5)名称与标识符

名称

英文别名：

9,10-Anthracenedione,1,2,5-trihydroxy-6-methyl-;1,2,5-trihydroxy-6-methylanthracene-9,10-dione;1,5,6-trihydroxy-2-methyl-anthracene-9,10-dione;1,2,5-trihydroxy-6-methyl-9,10-anthracenedione;1,2,5-Trihydroxy-6-methyl-anthrachinon;1,2,5-trihydroxy-6-methylanthraquinone;1,2,5-trihydroxy-6-methyl-anthraquinone;6-methyl-1,2,5-trihydroxyanthraquinone;AC1L9DCT;AG-F-62724;C10376;CTK4J0365;Morindone;Q6912244;1,2,5-TRIHYDROXY-6-METHYL-9,10-DIHYDROANTHRACENE-9,10-DIONE;DTXSID80197280;SCHEMBL10909836;9,10-Anthracenedione, 1,2,5-trihydroxy-6-methyl-;PB6GBU5T6V;SureCN10909836;ANTHRAQUINONE, 1,2,5-TRIHYDROXY-6-METHYL-;1,2,5-trihydroxy-6-methyl-anthracene-9,10-dione;Morindon;CHEBI:7000;C.I. 75430;UNII-PB6GBU5T6V;478-29-5;NS00031727;

标识符

InChIKey：

BATFHSIVMJJJAF-UHFFFAOYSA-N

Inchi：

1S/C15H10O5/c1-6-2-3-7-10(12(6)17)13(18)8-4-5-9(16)15(20)11(8)14(7)19/h2-5,16-17,20H,1H3

SMILES：

OC1=C(C)C=CC2C(C3C(=C(C=CC=3C(C=21)=O)O)O)=O

9,10-蒽二酮，1,2,5-三羟基-6-甲基-(478-29-5)物化性质

实验特性

PSA : 94.83
折射率 : 1.744
沸点 : 494.8°Cat760mmHg
闪点 : 267.1°C
密度 : 1.583

计算特性

精确分子量 : 270.0528
氢键供体数量 : 3
氢键受体数量 : 5
可旋转化学键数量 : 0
同位素质量 : 270.053
重原子数量 : 20
复杂度 : 434
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 3.3
互变异构体数量 : 276
表面电荷 : 0
拓扑分子极性表面积 : 94.8Å²

9,10-蒽二酮，1,2,5-三羟基-6-甲基-(478-29-5)相关文献

1. LXVI.—Morindone
John Lionel Simonsen J. Chem. Soc. Trans. 1918 113 766
2. 116. Chemistry of the Coprosma genus. Part I. The colouring matters from Coprosma australis
Lindsay H. Briggs,Jack C. Dacre J. Chem. Soc. 1948 564
3. LXVII.—Colouring and other principles contained in mang-koudu
A. G. Perkin,J. J. Hummel J. Chem. Soc. Trans. 1894 65 851
4. Notes
E. G. E. Hawkins,W. F. Maddams,A. C. Hazell,D. S. Urch,David A. Buckingham,J. L. E. Cheong,J. E. Fergusson,C. J. Wilkins,Ernst D. Bergmann,Arnon Shani,B. C. Saunders,P. Simpson,Edmond N. Gabali,Elhosseiny M. Abdallah,R. C. Cambie,E. R. H. Jones,G. Lowe,J. L. Boston,S. O. Grim,G. Wilkinson,Lindsay H. Briggs,P. W. Le Quesne,J. A. Silk,L. A. Summers,G. Valkanas,H. Hopff J. Chem. Soc. 1963 3456
5. XXXVII.—Note on morindone
John Stenhouse J. Chem. Soc. 1864 17 333
6. Naturally occurring quinones. Part XIX. Anthraquinones in hymenodictyon excelsum and damnacanthus major
E. J. C. Brew,R. H. Thomason J. Chem. Soc. C 1971 2001
7. Organic chemistry
J. Chem. Soc. Abstr. 1918 114 i521
8. Fruits and their phytochemicals in mitigating the ill effects of ionizing radiation: review on the existing scientific evidence and way forward
Shamprasad Varija Raghu,Suresh Rao,Venkataramana Kini,Avinash Kundadka Kudva,Thomas George,Manjeshwar Shrinath Baliga Food Funct. 2023 14 1290
9. Recent discovery of plant-derived anti-diabetic natural products
Hsin-Yi Hung,Keduo Qian,Susan L. Morris-Natschke,Chau-Shin Hsu,Kuo-Hsiung Lee Nat. Prod. Rep. 2012 29 580
10. One-pot green synthesis of silver nanocrystals using Hymenodictyon orixense: a cheap and effective tool against malaria, chikungunya and Japanese encephalitis mosquito vectors?
Marimuthu Govindarajan,Giovanni Benelli RSC Adv. 2016 6 59021