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Substance Name: Perhydrohistrionicotoxin
RN: 40709-29-3
InChIKey: BTKHRQIWTGOESJ-AKHDSKFASA-N

Classification Codes

  • Autonomic Agents
  • Parasympatholytics
  • Peripheral Nervous System Agents

Molecular Formula

  • C19-H37-N-O

Molecular Weight

  • 295.507
 
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Names and Synonyms

Name of Substance

  • Perhydrohistrionicotoxin

Synonym

  • H(12)-Htx

Systematic Names

  • 1-Azaspiro(5.5)undecan-8-ol, 7-butyl-2-pentyl-, (2R,6R,7S,8S)-
  • 1-Azaspiro(5.5)undecan-8-ol, 7-butyl-2-pentyl-, (6R-(6alpha(R*),7beta,8alpha))-

Registry Numbers

CAS Registry Number

  • 40709-29-3

System Generated Number

  • 0040709293

Structure Descriptors

InChI

1S/C19H37NO/c1-3-5-7-10-16-11-8-14-19(20-16)15-9-13-18(21)17(19)12-6-4-2/h16-18,20-21H,3-15H2,1-2H3/t16-,17-,18+,19-/m1/s1

InChIKey

BTKHRQIWTGOESJ-AKHDSKFASA-N

Smiles

N1[C@@]2(CCC[C@@H]([C@H]2CCCC)O)CCC[C@H]1CCCCC