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Substance Name: 3,4-Piperidinediol, 4-(3-(diethylamino)-1-propynyl)-1,3-dimethyl-6-(4-fluorophenyl)-, (3-alpha,4-beta,6-beta)-
RN: 120768-88-9
InChIKey: KUNNLVKNBLKQOX-UFYCRDLUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H29-F-N2-O2

Molecular Weight

  • 348.4591
 
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Names and Synonyms

Synonyms

  • BRN 3565328
  • cis-4-(3-(Diethylamino)propynyl)-1,3-dimethyl-6-(4-fluorophenyl)-3,4-piperidinediol

Systematic Names

  • 3,4-Piperidinediol, 4-(3-(diethylamino)-1-propynyl)-1,3-dimethyl-6-(4-fluorophenyl)-, (3-alpha,4-beta,6-beta)-
  • 3,4-Piperidinediol, 4-(3-(diethylamino)-1-propynyl)-6-(4-fluorophenyl)-1,3-dimethyl-, (3alpha,4beta,6beta)-

Registry Numbers

CAS Registry Number

  • 120768-88-9

System Generated Number

  • 0120768889

Structure Descriptors

InChI

1S/C20H29FN2O2/c1-5-23(6-2)13-7-12-20(25)14-18(22(4)15-19(20,3)24)16-8-10-17(21)11-9-16/h8-11,18,24-25H,5-6,13-15H2,1-4H3/t18-,19-,20-/m0/s1

InChIKey

KUNNLVKNBLKQOX-UFYCRDLUSA-N

Smiles

CCN(CC)CC#C[C@@]1(C[C@H](N(C[C@]1(C)O)C)c2ccc(cc2)F)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 263mg/kg (263mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 23, Pg. 178, 1989.