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Substance Name: 4-Cyclohexene-1,2-diol, 3,6-di-1-piperidinyl-, dihydrochloride, (1-alpha,2-beta,3-alpha,6-beta)-
RN: 137866-74-1
InChIKey: OVMCATMUVQXWLT-VGQSLNHCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H28-N2-O2.2Cl-H

Molecular Weight

  • 353.331
 
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Names and Synonyms

  • 4-Cyclohexene-1,2-diol, 3,6-di-1-piperidinyl-, dihydrochloride, (1-alpha,2-beta,3-alpha,6-beta)-

Registry Numbers

CAS Registry Number

  • 137866-74-1

System Generated Number

  • 0137866741

Molecular Formulas

Molecular Formula

  • C16-H28-N2-O2.2Cl-H

Molecular Formula Fragments

  • C16-H28-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C16H28N2O2.2ClH/c19-15-13(17-9-3-1-4-10-17)7-8-14(16(15)20)18-11-5-2-6-12-18;;/h7-8,13-16,19-20H,1-6,9-12H2;2*1H/t13-,14-,15+,16+;;/m1../s1

InChIKey

OVMCATMUVQXWLT-VGQSLNHCSA-N

Smiles

C1CCN(CC1)[C@@H]2C=C[C@H]([C@@H]([C@H]2O)O)N3CCCCC3.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 746mg/kg (746mg/kg)   Pharmaceutical Chemistry Journal Vol. 25, Pg. 632, 1991.