163343-71-3 ((S)-3-哌啶甲酸乙酯-D-酒石酸盐,(S)-Ethyl nipecotate D-tartrate)

(S)-3-哌啶甲酸乙酯-D-酒石酸盐(163343-71-3)名称与标识符

名称

中文别名:
(S)-3-哌啶甲酸乙酯-D-酒石酸盐;(S)-3-哌啶甲酸乙酯 D-酒石酸盐;
英文别名:
(S)-Ethyl piperidine-3-carboxylate (2S,3S)-2,3-dihydroxysuccinate;(S)-Ethyl piperidine-3-carboxylate (2S,3S)-2,3-dihydroxysuccite;Ethyl (3S)-nipecotate D-tartrate;(3S)-3-Piperidinecarboxylic acid ethyl ester (2S,3S)-2,3-dihydroxybutanedioate;Ethyl (S)-3-Piperidinecarboxylate D-Tartrate;(S)-Ethyl nipecotate-D-tartrate;Ethyl (S)-nipecotate,D-tartrate;(S)-3-Piperidinecarboxylic Acid Ethyl Ester D-Tartrate;(S)-Nipecotic Acid Ethyl Ester D-Tartrate;Ethyl (S)-nipecotate-D-tartrate;(S)-Ethyl nipecotate D-tartrate;HHPGQKZOPPDLNH-ZZQRGORHSA-N;FC0475;SBB066252;DT2050;Eth;(S)-Ethyl piperidine-3-carboxylate xD-Tartaric acid salt;MFCD03093639;N0681;83602-38-4;ethyl (3S)-3-piperidinecarboxylate D(-)-tartarate;AC-22460;Ethyl (S)-nipecotate L-tartrate;(2S,3S)-2,3-dihydroxybutanedioic acid;ethyl (3S)-piperidine-3-carboxylate;(s)-ethyl 3-piperidinecarboxylate d-tartrate salt;L-(+)-tartaric acid; ethyl (3S)-piperidine-3-carboxylate;(S)-Ethylpiperidine-3-carboxylatexD-Tartaricacidsalt;60218-50-0;DS-14407;CS-0188170;AKOS015896218;C12H21NO8;163343-71-3;

标识符

MDL:
S181904
InChIKey:
HHPGQKZOPPDLNH-ZZQRGORHSA-N
Inchi:
1S/C8H15NO2.C4H6O6/c1-2-11-8(10)7-4-3-5-9-6-7;5-1(3(7)8)2(6)4(9)10/h7,9H,2-6H2,1H3;1-2,5-6H,(H,7,8)(H,9,10)/t7-;1-,2-/m00/s1
SMILES:
O(CC)C([C@@H]1CNCCC1)=O.O[C@H](C(=O)O)[C@@H](C(=O)O)O

(S)-3-哌啶甲酸乙酯-D-酒石酸盐(163343-71-3)物化性质

计算特性

  • 精确分子量 : 307.12671663g/mol
  • 氢键供体数量 : 5
  • 氢键受体数量 : 9
  • 可旋转化学键数量 : 6
  • 同位素质量 : 307.12671663g/mol
  • 重原子数量 : 21
  • 复杂度 : 270
  • 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 : 2
  • 拓扑分子极性表面积 : 153

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(S)-3-哌啶甲酸乙酯-D-酒石酸盐(163343-71-3)参考资料

Beilstein:
S181904
PubChem CID: