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顺曲库胺缩合物草酸盐 | 96687-52-4

顺曲库胺缩合物草酸盐结构式图片|96687-52-4结构式图片
顺曲库胺缩合物草酸盐
(R,R)-N,N'-Didemethyl Atracurium Oxalate
96687-52-4
C53H68N2O16
989.110836982727
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:顺曲库胺缩合物草酸盐结构式
名称和标识符
InChIKey CTRHJROIKMLEGA-RONWPTNUSA-N
Inchi 1S/C51H66N2O12.C2H2O4/c1-56-42-14-12-34(28-44(42)58-3)26-40-38-32-48(62-7)46(60-5)30-36(38)16-20-52(40)22-18-50(54)64-24-10-9-11-25-65-51(55)19-23-53-21-17-37-31-47(61-6)49(63-8)33-39(37)41(53)27-35-13-15-43(57-2)45(29-35)59-4;3-1(4)2(5)6/h12-15,28-33,40-41H,9-11,16-27H2,1-8H3;(H,3,4)(H,5,6)/t40-,41-;/m1./s1
SMILES C(=O)(O)C(=O)O.C(C1C=CC(OC)=C(OC)C=1)[C@H]1N(CCC(=O)OCCCCCOC(=O)CCN2CCC3C=C(C(=CC=3[C@H]2CC2C=CC(OC)=C(OC)C=2)OC)OC)CCC2=CC(=C(C=C12)OC)OC
别名信息
- 中文别名 -
  • (1R,1R')-2,2'-(3,11-二氧代-4,10-二氧杂-1,13-亚十三烷基)-双-[6,7-二甲氧基-1-(3,4-二甲氧基苄基)-1,2,3,4-四氢异喹啉]草酸盐
  • (R*,R*)-(-)-1-[(3,4-二甲氧基苯基)甲基]-3,4-二氢-6,7-二甲氧基-2(1H)-异喹啉丙酸 1,5-戊二醇酯二草酸盐
  • (1R,1'R)-2,2'-(3,11-二氧杂-1,13-亚十三烷基)-双-[6,7-二甲氧基-1-(3,4-二甲氧基苄基)-1,2,3,4-四氢异喹啉]草酸盐(顺阿曲库铵草酸盐)
  • (1R,1R’)-2,2’-(3,11-二氧代-4,10-二氧杂-1,13-亚十三烷基)-双-[6,7-二甲氧基-1-(3,4-二甲氧基苄基)-1,2,3,4-四氢异喹啉]草酸盐
  • (顺阿曲库铵草酸盐)
  • 顺阿曲库铵草酸盐
  • 顺阿曲库铵缩合物草酸盐
  • 顺阿曲库胺草酸盐
  • 顺曲库铵缩合物草酸盐
  • 顺曲库胺缩合物草酸盐
  • 顺苯磺阿曲库铵中间体
  • (1R,1'R)-阿曲库铵草酸盐
- 英文别名 -
  • (1R,1'R)-2,2'-(3,11-Dioxo-4,10-dioxatridecamethylene)-bis-(1,2,3,4-tetrahydro-6,7-dimethoxy-1-veratrylisoquindline)-dioxalate
  • (R*,R*)-(-)-1-[(3,4-Dimethoxyphenyl)methyl]-3,4-dihydro-6,7-dimethoxy-2(1H)-isoquinolinepropanoic acid 1,5-pentanediyl ester ethanedioate (1:2)
  • (1R,1’R)-ATRACURIUM DIOXALATE
  • (1R,1'R)-2,2'-(3,11-dioxatridecamethylene)-bis-(1,2,3,4-tetrahydro-6,7-dimethoxy-1-veratrylisoquinoline)dioxalate(Cisatracurium oxalate)
  • (1R,1'R)-2,2'-(3,11-Dioxo-4,10-dioxatridecamethylene)-bis-(1,2,3,4-tetrahydro-6,7-dimethoxy-1-veratrylisoquindline)-diox
  • 5-[3-[(1S)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[(1R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propa
  • Cis Atracurium dioxalate
  • CisAtracurium Oxalate
  • 5-[3-[(1S)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoyloxy]pentyl 3-[(1R)-1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl]propanoate,oxalic acid
  • R-atracurium dioxalate
  • 2(1H)-Isoquinolinepropanoic acid, 1-[(3,4-dimethoxyphenyl)methyl]-3,4-dihydro-6,7-dimethoxy-, 1,5-pentanediyl ester, (R*,R*)-(-)-, ethanedioate (1:2) (9CI)
物化性质
实验特性
LogP 5.96330
PSA 282.12000
计算特性
精确分子量 1078.45000
氢键供体数量 4
氢键受体数量 22
可旋转化学键数量 28
重原子数量 77
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