MDL | MFCD07636810 |
InChIKey | GVKKJJOMQCNPGB-JTQLQIEISA-N |
Inchi | 1S/C19H20O3/c1-10-9-22-18-12-6-7-13-11(5-4-8-19(13,2)3)15(12)17(21)16(20)14(10)18/h6-7,10H,4-5,8-9H2,1-3H3/t10-/m0/s1 |
SMILES | O1C([H])([H])[C@]([H])(C([H])([H])[H])C2C(C(C3=C(C([H])=C([H])C4=C3C([H])([H])C([H])([H])C([H])([H])C4(C([H])([H])[H])C([H])([H])[H])C1=2)=O)=O |
LogP | 3.44330 |
PSA | 43.37000 |
折射率 | 1.602 |
沸点 | 459℃ at 760 mmHg |
熔点 | 192°C(lit.) |
闪点 | 203.4±28.8 °C |
溶解度 | DMSO: ≥5mg/mL |
颜色与性状 | Red cryst. |
敏感性 | 对光敏感 |
最大波长(λmax) | 263(lit.) |
光学活性 | [α]/D -85.0±3.0°, c = 0.1 in chloroform |
密度 | 1.2300 |
精确分子量 | 296.14100 |
氢键供体数量 | 0 |
氢键受体数量 | 3 |
可旋转化学键数量 | 0 |
同位素质量 | 296.14124450 g/mol |
重原子数量 | 22 |
复杂度 | 571 |
同位素原子数量 | 0 |
确定原子立构中心数量 | 1 |
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) | 3.8 |
拓扑分子极性表面积 | 43.4 |
分子量 | 296.4 |
海关编码 | 2932999099 |
海关数据 |
中国海关编码:2932999099概述:2932999099. 其他仅含氧杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0% 申报要素:品名, 成分含量, 用途 Summary:2932999099. other heterocyclic compounds with oxygen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
用途 | 具有抗氧化、抗衰老功能,对治疗冠心病、心绞痛、心肌损害有一定疗效。 |
1.
Cryptotanshinone inhibits proliferation and induces apoptosis via mitochondria-derived reactive oxygen species involving FOXO1 in estrogen receptor-negative breast cancer Bcap37 cells
Xiaoman Liu,Lili Pan,Junling Liang,Jinhui Li,Shihua Wu RSC Adv. 2016 6 22232
2.
Screening target components from Radix salviae miltiorrhiae using an EGFR/CMC-online-HPLC/MS method
Sheng-Li Han,Tao Zhang,Jing Huang,Zhi-Gang Hu,Si-Cen Wang Anal. Methods 2012 4 1078
3.
Anticancer activity in human multiple myeloma U266 cells: synergy between cryptotanshinone and arsenic trioxide
Pei Liu,Shi Xu,Min Zhang,Wen Wen Wang,Yan Fang Zhang,Kanwal Rehman,Hua Naranmandura,Zhe Chen Metallomics 2013 5 871
4.
A novel hollow fiber/graphene oxide/solvent bar microextraction coupled with high performance liquid chromatography for preconcentration and determination of tanshinones and salvianolic acids in Radix Salvia miltiorrhiza
Wen-Yan Ma,Rong-Rong Xing,Shuang Hu,Xuan Chen,Xiao-Hong Bai Anal. Methods 2014 6 7285
5.
An in vitro affinity-based method for studying herb–drug interactions for direct identification of cytochrome P450 1A2, 3A4, and 2C9 specific ligands from herbal extracts using ultrafiltration-high performance liquid chromatography
Zhiqiang Wang,Seung Hwan Hwang,Guanglei Zuo,Set Byeol Kim,Soon Sung Lim RSC Adv. 2018 8 8944
6.
Recent advances in the discovery of protein tyrosine phosphatase SHP2 inhibitors
Jiao Kong,Ya-Qiu Long RSC Med. Chem. 2022 13 246
7.
An activity-calibrated chemical standardization approach for quality evaluation of Salvia miltiorrhiza Bge.
Zhen-jie Liu,Zhi-long Shi,Can Tu,Hai-zhu Zhang,Dan Gao,Chun-yu Li,Qin He,Rui-sheng Li,Yu-ming Guo,Ming Niu,Cong-en Zhang,Yong-shen Ren,Han-shen Zhen,Jia-bo Wang,Xiao-he Xiao RSC Adv. 2017 7 5331
8.
Biosynthesis and absolute configuration of diterpene cryptotanshinone from Salvia miltiorrhiza: stereochemistry of methyl migration in the formation of the abietane skeleton determined by incorporation of D-[U-13C6]glucose
Yutaka Tomita,Yasumasa Ikeshiro J. Chem. Soc. Chem. Commun. 1987 1311
9.
Naturally occurring quinones. Part XI. The tanshinones
A. C. Baillie,R. H. Thomson J. Chem. Soc. C 1968 48
10.
Biosynthesis, total syntheses, and antitumor activity of tanshinones and their analogs as potential therapeutic agents
Yizhou Dong,Susan L. Morris-Natschke,Kuo-Hsiung Lee Nat. Prod. Rep. 2011 28 529
PubChemId | 354334480 |
Reaxys RN | 5445400 |
Beilstein | 5445400 |
物理化学性质
外观性状 橙色针状结晶(甲醇)
熔点 184℃~185℃
溶解性 溶于甲醇、乙醇、苯、乙醚,易溶于丙酮、氯仿。与浓硫酸作用显红色。在避光及非溶液状态下最稳定。
产品用途
隐丹参酮具有抑菌作用,1mg/ml对金黄色葡萄球菌及绿脓杆菌均有抑制作用,对溶血性链球菌亦有一定抑制作用。
应用领域
上下游产品信息
化学品安全说明书(MSDS)
储运特性