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Substance Name: 3,4-Piperidinediol, 4-(3-(diethylamino)-1-propynyl)-1,3-dimethyl-6-(4-methylphenyl)-, (3-alpha,4-beta,6-beta)-
RN: 120729-83-1
InChIKey: KWXYJSJMEVGYPQ-ACRUOGEOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H32-N2-O2

Molecular Weight

  • 344.4958
 
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Names and Synonyms

Synonyms

  • BRN 3564282
  • cis-4-(3-(Diethylamino)propynyl)-1,3-dimethyl-6-(4-methylphenyl)-3,4-piperidinediol

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 120729-83-1

System Generated Number

  • 0120729831

Structure Descriptors

InChI

1S/C21H32N2O2/c1-6-23(7-2)14-8-13-21(25)15-19(22(5)16-20(21,4)24)18-11-9-17(3)10-12-18/h9-12,19,24-25H,6-7,14-16H2,1-5H3/t19-,20-,21-/m0/s1

InChIKey

KWXYJSJMEVGYPQ-ACRUOGEOSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 103mg/kg (103mg/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.