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氟伐他汀甲酯 | 93957-53-0

氟伐他汀甲酯结构式图片|93957-53-0结构式图片
氟伐他汀甲酯
Fluvastatin Methyl Ester
93957-53-0
C25H28FNO4
425.492530822754
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:氟伐他汀甲酯结构式
氟伐他汀甲酯价格
名称和标识符
MDL MFCD22683920
InChIKey BOCZYIUKFAQNLG-DSJWGCTQSA-N
Inchi 1S/C25H28FNO4/c1-16(2)27-22-7-5-4-6-21(22)25(17-8-10-18(26)11-9-17)23(27)13-12-19(28)14-20(29)15-24(30)31-3/h4-13,16,19-20,28-29H,14-15H2,1-3H3/b13-12+/t19-,20-/m0/s1
SMILES C(/C1N(C(C)C)C2C=CC=CC=2C=1C1C=CC(F)=CC=1)=C\[C@H](O)C[C@H](O)CC(=O)OC
别名信息
- 中文别名 -
  • 氟伐他汀甲酯
  • (3R,5S,6E)-7-[3-(4-氟苯基)-1-(1-甲基乙基)-1-氢-吲哚-2-基]-3,5-二羟基庚-6-烯酸甲酯
  • [3R,5S-(E)]-7-[3-(4-氟苯基)-1-异丙基-1H-吲哚-2-基]-3,5-二羟基-6-庚烯酸叔丁酯
  • 1-溴-3,7-二甲基辛烷
  • Q-3: 氟伐二醇
- 英文别名 -
  • (3S,5R,E)-Methyl 7-(3-(4-fluorophenyl)-1-isopropyl-1H-indol-2-yl)-3,5-dihydroxyhept-6-enoate
  • luvastatin methyl ester
  • methyl (3r,5s,6e)-7-[3-(4-fluorophenyl)-1-(1-methylethyl)-1h-indol-2-yl]-3,5-dihydroxy-6-heptenoate
  • Fluvastatin F-4
  • Fluvastatin Methyl Ester
  • (3R,5S,6E)-rel-7-[3-(4-Fluorophenyl)-1-(1-Methylethyl)-1H-indol-2-yl]-3,5-dihydroxy-6-heptenoic Acid Methyl Ester
  • [R*,S*-(E)]-(+/-)-7-[3-(4-Fluorophenyl)-1-(1-Methylethyl) -1H-indol-2-yl]-3,5-dihydroxy-6-heptenoic Acid Methyl Ester
  • methyl erythro-(E)-3,5-dihydroxy-7-[3-(4-fluorophenyl)-1-(1-methylethyl)indol-2-yl]hept-6-enoate
  • 6-Heptenoic acid, 7-[3-(4-fluorophenyl)-1-(1-methylethyl)-1H-indol-2-yl]-3,5-dihydroxy-, methyl ester, [R*,S*-(E)]-(±)- (ZCI)
  • rel-Methyl (3R,5S,6E)-7-[3-(4-fluorophenyl)-1-(1-methylethyl)-1H-indol-2-yl]-3,5-dihydroxy-6-heptenoate (ACI)
  • (3R,5S,6E)-rel-7-[3-(4-Fluorophenyl)-1-(1-methylethyl)-1H-indol-2-yl]-3,5-dihydroxy-6-heptenoic acid methyl ester
  • 6-Heptenoic acid, 7-[3-(4-fluorophenyl)-1-(1-methylethyl)-1H-indol-2-yl]-3,5-dihydroxy-, methyl ester, [R*,S*-(E)]-
物化性质
实验特性
LogP 4.71650
PSA 71.69000
计算特性
精确分子量 425.20000
合成路线

合成路线:1 步

参考文献:
Stereoselective preparation of erythro-E-3,5-dihydroxy-7-[3'(4"-fluorophenyl)-1'(1"-methylethyl)indol-2'yl]heptenoates
, European Patent Organization, , ,

合成路线:1 步

反应条件:
参考文献:
Synthesis of (3R,5S,6E)-rel-7-[3-(4-fluorophenyl)-1-(1-methylethyl)-1H-indol-2-yl]-3,5-dihydroxy-6-Heptenoic acid sodium salt (1:1) (fluvastatin sodium)
Jin, Hong-ri; Chen, Xiao-fang; Yan, Qi-dong; Yang, Mei-ling, Hecheng Huaxue, 2008, 16(3), 358-361

合成路线:1 步

参考文献:
Method for separation of optically active aryldihydroxyheptenoic acid esters
, World Intellectual Property Organization, , ,

合成路线:1 步

参考文献:
Analogs of mevalolactone and derivatives thereof and their use as pharmaceuticals
, World Intellectual Property Organization, , ,

合成路线:1 步

反应条件:
参考文献:
Process for preparation of fluvastatin and intermediates
, China, , ,

合成路线:1 步

反应条件:
参考文献:
Process and intermediates for the selective synthesis of fluvastatin
, World Intellectual Property Organization, , ,

合成路线:1 步

反应条件:
参考文献:
Synthesis of (3R,5S,6E)-rel-7-[3-(4-fluorophenyl)-1-(1-methylethyl)-1H-indol-2-yl]-3,5-dihydroxy-6-heptenoic acid sodium salt (fluvastatin sodium)
Cai, Zhengyan; Ning, Qi; Zhou, Weicheng, Zhongguo Yiyao Gongye Zazhi, 2007, 38(2), 73-75
化合物详情(旧版)

SMILES

COC(=O)CC(O)CC(O)C=CC1=C(C2=CC=C(F)C=C2)C3C(=CC=CC=3)N1C(C)C

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