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去甲斑蝥素 | 29745-04-8

去甲斑蝥素
(±)-Norcantharidin
29745-04-8
C8H8O4
168.1467
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:去甲斑蝥素结构式
9877482
去甲斑蝥素价格
名称和标识符
MDL MFCD00213361
InChIKey JAABVEXCGCXWRR-UHFFFAOYSA-N
Inchi 1S/C8H8O4/c9-7-5-3-1-2-4(11-3)6(5)8(10)12-7/h3-6H,1-2H2
SMILES O1C2([H])C([H])([H])C([H])([H])C1([H])C1([H])C(=O)OC(C12[H])=O
BRN 0084287
别名信息
- 中文别名 -
  • 去甲斑蝥素
  • 7-氧杂二环[2.2.1]庚烷-2,3-二羧酸酐
  • 3-(氯甲基)-1-甲基-1H-吡唑
  • Norcantharidin 去甲斑蝥素
  • 去甲斑蝥素Norcantharidin
  • 外向-7-噁双环[2.2.1]庚烷-2,3-二羧酸酐
  • 外型-7-氧杂二环[2.2.1]庚烷-2,3-二羧酸酐
  • exo-3,6-环氧六氢邻苯二甲酸酐
  • exo-7-氧杂二环[2.2.1]庚烷-2,3-二羧酸酐
  • 外-7-氧杂二环[2.2.1]庚烷-2,3-二甲酸酐
  • 外-3,6-环氧六氢邻苯二甲酸酐
- 英文别名 -
  • Norcantharidin
  • 7-Oxabicyclo[2.2.1]heptane-2,3-dicarboxylic Anhydride
  • 4,10-Dioxatricyclo[5.2.1.0(2,6)]decane-3,5-dione
  • Norcantharadine
  • 4,10-dioxatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione
  • 7-oxabicyclo[2,2,1]heptane-2,3-dicarboxylc acid anhydride
  • 7-oxabicyclo[2,2,1]heptane-2,3-dicarboxylic acid anhydride
  • deme
  • endothallanhydride
  • exo,exo-4,10-dioxatricyclo[5.2.1.02.6]decane-3,5-dione
  • exo-3,6-Epoxyhexahydrophthalic Anhydride
  • Exo-7-oxabicyclo(2.2.1)h
  • exo-7-Oxabicyclo[2.2.1]heptane-2,3-dicarboxylic Anhydride
  • Isocantharidin
  • norcantharadin
  • Endothall anhydride
  • 4,7-Epoxyisobenzofuran-1,3-dione, hexahydro-
  • 3,6-Endoxohexahydrophthalic anhydride
  • Hexahydro-4,7-epoxyisobenzofuran-1,3-dione
  • 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic anhydride
  • 3,6-Endooxyphthalic anhydride, hexahydro-
  • Phthalic anhydride, hexahydro-3,6-endoxo-
  • C8H8O4
  • 4,10-dioxatricyclo[5.2.1.0<2,6>]decane-3,5-dione
  • sodium norcantha
  • (±)-NCTD
  • (±)-Norcantharidin
  • (3aR,4S,7R,7aS)-hexahydro-4,7-epoxyisobenzofuran-1,3-dione
  • (3aR,4S,7R,7aS)-hexahydro-4,7-epoxyisobenzofuran-1,3-dione
  • ( inverted exclamation markA)-NCTD
  • ( inverted exclamation markA)-NCTD
  • UNII-8452E71EO7
  • UNII-8452E71EO7
  • D97665
  • D97665
  • N0914
  • N0914
  • (1R,2S,6R,7S)-4,10-DIOXATRICYCLO[5.2.1.0,2,6]DECANE-3,5-DIONE
  • (1R,2S,6R,7S)-4,10-DIOXATRICYCLO[5.2.1.0,2,6]DECANE-3,5-DIONE
  • AKOS006276813
  • AKOS006276813
  • ( inverted exclamation markA)-Norcantharidin
  • ( inverted exclamation markA)-Norcantharidin
  • Z1198158002
  • Z1198158002
  • ()-NCTD
  • ()-NCTD
  • BDBM50090503
  • BDBM50090503
  • NORCANTHARIDIN, (+/-)-
  • NORCANTHARIDIN, (+/-)-
  • CHEMBL298246
  • CHEMBL298246
  • NSC 59023
  • NSC 59023
  • BRN 0084287
  • BRN 0084287
  • (3aR,4S,7R,7aS)-hexahydro-4,7-epoxy-2-benzofuran-1,3-dione
  • (3aR,4S,7R,7aS)-hexahydro-4,7-epoxy-2-benzofuran-1,3-dione
  • 7-OXABICYCLO(2.2.1)HEPTANE-EXO-CIS-2,3-DICARBOXYLIC ANHYDRIDE
  • 7-OXABICYCLO(2.2.1)HEPTANE-EXO-CIS-2,3-DICARBOXYLIC ANHYDRIDE
  • REL-(3AR,4S,7R,7AS)-HEXAHYDRO-4,7-EPOXYISOBENZOFURAN-1,3-DIONE
  • REL-(3AR,4S,7R,7AS)-HEXAHYDRO-4,7-EPOXYISOBENZOFURAN-1,3-DIONE
  • cid_6852411
  • cid_6852411
  • HY-N0291
  • HY-N0291
  • NSC-14003
  • NSC-14003
  • 8452E71EO7
  • 8452E71EO7
  • NORCANTHARIDIN [WHO-DD]
  • NORCANTHARIDIN [WHO-DD]
  • 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic anhydride, exo-
  • 7-Oxabicyclo(2.2.1)heptane-2,3-dicarboxylic anhydride, exo-
  • exo-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic anhydride
  • exo-7-oxabicyclo[2.2.1]heptane-2,3-dicarboxylic anhydride
  • AC-4860
  • AC-4860
  • 4,7-Epoxyisobenzofuran-1,3-dione, hexahydro-, (3aR,4S,7R,7aS)-rel-
  • 4,7-Epoxyisobenzofuran-1,3-dione, hexahydro-, (3aR,4S,7R,7aS)-rel-
  • SCHEMBL3187662
  • SCHEMBL3187662
  • Rel-Norcantharidin
  • Rel-Norcantharidin
  • 4,7-Epoxyisobenzofuran-1,3-dione, hexahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-
  • 4,7-Epoxyisobenzofuran-1,3-dione, hexahydro-, (3a-alpha,4-beta,7-beta,7a-alpha)-
  • CS-0008782
  • CS-0008782
  • (1S,2R,6S,7R)-4,10-Dioxa-tricyclo[5.2.1.0*2,6*]decane-3,5-dione
  • (1S,2R,6S,7R)-4,10-Dioxa-tricyclo[5.2.1.0*2,6*]decane-3,5-dione
  • rel-(3aR,4R,7S,7aS)-Hexahydro-4,7-epoxyisobenzofuran-1,3-dione
  • rel-(3aR,4R,7S,7aS)-Hexahydro-4,7-epoxyisobenzofuran-1,3-dione
  • EN300-1705964
  • EN300-1705964
  • ()-Norcantharidin
  • DTXSID901017225
  • ()-Norcantharidin
  • DTXSID901017225
  • 4,7-EPOXYISOBENZOFURAN-1,3-DIONE, HEXAHYDRO-, (3A.ALPHA.,4.BETA.,7.BETA.,7A.ALPHA.)-
  • 4,7-EPOXYISOBENZOFURAN-1,3-DIONE, HEXAHYDRO-, (3A.ALPHA.,4.BETA.,7.BETA.,7A.ALPHA.)-
  • (1R,2S,6R,7S)-4,10-dioxatricyclo[5.2.1.02,6]decane-3,5-dione
  • (1R,2S,6R,7S)-4,10-Dioxa-tricyclo[5.2.1.0*2,6*]decane-3,5-dione
  • (1R,2S,6R,7S)-4,10-dioxatricyclo[5.2.1.02,6]decane-3,5-dione
  • NSC-59023
  • (1R,2S,6R,7S)-4,10-Dioxa-tricyclo[5.2.1.0*2,6*]decane-3,5-dione
  • 5-19-05-00041 (Beilstein Handbook Reference)
  • NSC-59023
  • 5-19-05-00041 (Beilstein Handbook Reference)
  • Demethylcantharidin
  • Demethylcantharidin
  • cid_93004
  • 29745-04-8
  • cid_93004
  • 29745-04-8
物化性质
实验特性
LogP -0.13660
PSA 52.60000
折射率 1.55
水溶性 Hydrolyzes in water.
沸点 362.5°Cat760mmHg
熔点 113.0 to 117.0 deg-C
闪点 167°C
溶解度 几乎不溶 (0.049 g/L) (25 ºC),
颜色与性状 白色固体
溶解性 未确定
敏感性 Moisture Sensitive
密度 1.468±0.06 g/cm3 (20 ºC 760 Torr),
计算特性
精确分子量 168.04200
氢键供体数量 0
氢键受体数量 4
可旋转化学键数量 0
同位素质量 168.042
重原子数量 12
复杂度 246
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 4
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) -0.1
互变异构体数量
表面电荷 0
拓扑分子极性表面积 52.6
分子量 168.15
国际标准相关数据
EINECS 14003
海关数据
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%

生产方法和用途
用途
用作抗肿瘤药
专业数据库参考
PubChemId 9877482
参考资料
Reaxys RN 84287
化合物详情(旧版)
 
扩展阅读
去甲斑蝥素 http://www.biopurify.cn/p-3094.html
产品用途
用作抗肿瘤药
960化工网为您提供去甲斑蝥素专业化合物百科信息,包括中文名,英文名,分子式,分子量,以及该化合物的CasNo.:29745-04-8,和相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等;| WAP 版:29745-04-8
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