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去氧鬼臼毒素 | 19186-35-7

去氧鬼臼毒素结构式图片|19186-35-7结构式图片
中文名称:去氧鬼臼毒素
英文名称:Deoxypodophyllotoxin
CAS No.:19186-35-7 分子式:C22H22O7 分子量:398.4059
植物源: 八角莲   
如需查看该化合物的详细结构式,mol文件,smile, InChi 请点击:去氧鬼臼毒素结构式
价格行情:去氧鬼臼毒素价格
国内供应商
去氧鬼臼毒素的其他展现形式
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简介
Deoxypodophyllotoxin (DPT),鬼臼毒素的衍生物,是一种木酚素,从 Anthriscus sylvestris分离,具有强效抗有丝分裂和抗病毒特性。Deoxypodophyllotoxin 作为靶向微管的活性分子,不仅抗有丝分裂剂而且作为有效的血管生成抑制剂,在肿瘤学中具有重大影响。Deoxypodophyllotoxin 诱导细胞自噬 (autophagy) 和细胞凋亡 (apoptosis)。 Deoxypodophyllotoxin 引起 DRG 神经元细胞内 Ca2+ 浓度增加。
名称和标识符
InChIKey ZGLXUQQMLLIKAN-SVIJTADQSA-N
Inchi 1S/C22H22O7/c1-24-17-6-12(7-18(25-2)21(17)26-3)19-14-8-16-15(28-10-29-16)5-11(14)4-13-9-27-22(23)20(13)19/h5-8,13,19-20H,4,9-10H2,1-3H3/t13-,19+,20-/m0/s1
SMILES O1C([C@]2([H])[C@]([H])(C3C([H])=C(C(=C(C=3[H])OC([H])([H])[H])OC([H])([H])[H])OC([H])([H])[H])C3=C([H])C4=C(C([H])=C3C([H])([H])[C@@]2([H])C1([H])[H])OC([H])([H])O4)=O
别名信息
- 中文别名 -
去氧鬼臼毒素 3-(N-叔丁氧羰基-氨基)-6-氯哒嗪 去氧鬼臼毒素、脱氧鬼臼毒素 去氧鬼臼脂素 去氧鬼臼毒素,去氧鬼臼脂素 脱氧鬼臼毒素 [ "脱氧鬼臼毒素" ]
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- 英文别名 -
DESOXYPODOPHYLLOTOXIN Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6- (5aH)-one,5,8,8a,9-tetrahydro-5-(3,4,5- trimethoxyphenyl)-,(5R,5aR,8aR)- Podophyllotoxin, deoxy- Anthricin deoxy- Deoxypodophyllotoxin SILICICOLIN 4-Deoxypodophyllotoxin anthric Nsc403148 Furo[3',4':6,7]naphtho[2,3-D]-1,3-dioxol-6(5ah)-one, 5,8,8A,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-,(5R,5ar,8ar)- Anthricin/Deoxypodophyllotoxin (-)-Deoxypodophyllotoxin Hernandion Hernandin (-)-Anthricin (-)-Desoxypodophyllotoxin Isodeoxypodophyllotoxin (5R,5aR,8aR)-5-(3,4,5-trimethoxyphenyl)-5,8,8a,9-tetrahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one C22H22O7 MLS002702900 Anthriscin Furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-6(5aH)-one, 5,8,8a,9-tetrahydro-5-(3,4,5-trimethoxyphenyl)-, (5R,5aR,8aR)-
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物化性质
 实验特性
LogP 2.91830
PSA 72.45000
折射率 1.587
沸点 564.5ºC at 760 mmHg
闪点 247ºC
颜色与性状 Powder
密度 1.304g/cm3
 计算特性
精确分子量 398.13700
氢键供体数量 0
氢键受体数量 7
可旋转化学键数量 4
同位素质量 398.137
重原子数量 29
复杂度 598
同位素原子数量 0
确定原子立构中心数量 3
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) 3.1
拓扑分子极性表面积 72.4
分子量 398.4
生产方法和用途
用途 1、去氧鬼臼毒素具有抗肿瘤活性。
相关文献

1. Biosynthesis of yatein in Anthriscus sylvestris
Norikazu Sakakibara,Shiro Suzuki,Toshiaki Umezawa,Mikio Shimada Org. Biomol. Chem. 2003 1 2474

2. Stereocontrolled synthesis of (±)-deoxypodophyllotoxin via the benzyl equivalent of the Peterson reaction
Seiichi Takano,Shizuo Otaki,Kunio Ogasawara J. Chem. Soc. Chem. Commun. 1985 485

3. Regioselective suprafacial 1,5-hydrogen shifts in o-quinodimethanes; a route to 4-deoxypodophyllotoxin
David W. Jones,Adrian M. Thompson J. Chem. Soc. Chem. Commun. 1988 1095

4. Biosynthesis, total synthesis, and pharmacological activities of aryltetralin-type lignan podophyllotoxin and its derivatives
Siyu Shen,Yuru Tong,Yunfeng Luo,Luqi Huang,Wei Gao Nat. Prod. Rep. 2022 39 1856

5. Design, synthesis and biological evaluation of 4′-demethyl-4-deoxypodophyllotoxin derivatives as novel tubulin and histone deacetylase dual inhibitors
Xuan Zhang,Jie Zhang,Mingbo Su,Yubo Zhou,Yi Chen,Jia Li,Wei Lu RSC Adv. 2014 4 40444

6. Recent advances in the total synthesis of 2,7′-cyclolignans
Han-Qiu Zhang,Chu-Xuan Yan,Jian Xiao,Ya-Wen Wang,Yu Peng Org. Biomol. Chem. 2022 20 1623

7. Synthesis of (±)-4-deoxypodophyllotoxin, (±)-podophyllotoxin and (±)-epipodophyllotoxin
David W. Jones,Adrian M. Thompson J. Chem. Soc. Perkin Trans. 1 1993 2541

8. Synthesis of 2,4-diaza-4-deoxypodophyllotoxin, a new analogue of podophyllotoxin possessing antitumour activity
Yukio Hitotsuyanagi,Yoichi Naka,Keiji Yamagami,Akihiro Fujii,Tetsuya Tahara J. Chem. Soc. Chem. Commun. 1995 49

9. Notes
A. I. Biggs,J. Baddiley,N. A. Hughes,A. L. James,K. B. L. Mathur,H. S. Mehra,Frank S. H. Head,M. M. Williamson,A. F. Trotman-Dickenson,G. J. O. Verbeke,C. C. Barraclough,J. Lewis,R. S. Nyholm,I. R. Beattie,T. Gilson,M. D. Patel,J. M. Rowson,D. A. H. Taylor,J. R. B. Boocock,W. J. Hickinbottom,J. Davoll,K. A. Kerridge,A. R. Battersby,I. A. Greenock,J. R. Miller,A. G. Sharpe,J. Biggs,P. Sykes,H. J. Emeléus,D. E. MacDuffie,B. F. Cain J. Chem. Soc. 1961 2572

10. New frontiers in the transition-metal-free synthesis of heterocycles from alkynoates: an overview and current status
Imtiaz Khan,Sumera Zaib,Aliya Ibrar Org. Chem. Front. 2020 7 3734

化合物详情(旧版)

SMILES

COC1C=C(C=C(OC)C=1OC)[C@@H]2C3C(=CC4=C(OCO4)C=3)C[C@@H]5[C@@H]2C(=O)OC5


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