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Substance Name: Echitamine
RN: 6871-44-9
UNII: OTH5TH48VK
InChIKey: AFJPGVUCVDCFPM-OBYWIAIFSA-N

Classification Code

  • Natural Product

Molecular Formula

  • C22-H29-N2-O4

Molecular Weight

  • 385.4811
 
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Names and Synonyms

Name of Substance

  • Echitamine

Synonyms

  • BRN 4164538
  • Ditaine
  • Echetamine base
  • Echitamine
  • EINECS 229-968-4
  • NSC 296565
  • UNII-OTH5TH48VK

Systematic Names

  • 2,4(1H)-Cyclo-3,4-secoakuammilanium, 3,17-dihydroxy-16-(methoxycarbonyl)-4-methyl-, (3-beta,16R)-
  • Echitamine

Registry Numbers

CAS Registry Number

  • 6871-44-9

FDA UNII

  • OTH5TH48VK

Other Registry Numbers

  • 1356-78-1
  • 23106-72-1

System Generated Number

  • 0006871449

Structure Descriptors

InChI

1S/C22H29N2O4/c1-4-14-12-24(2)10-9-21-15-7-5-6-8-17(15)23-22(21,24)18(26)11-16(14)20(21,13-25)19(27)28-3/h4-8,16,18,23,25-26H,9-13H2,1-3H3/q+1/b14-4-/t16-,18-,20?,21-,22-,24-/m0/s1

InChIKey

AFJPGVUCVDCFPM-OBYWIAIFSA-N

Smiles

COC(=O)C1(CO)[C@H]2C[C@H](O)[C@@]34Nc5ccccc5[C@@]13CC[N@@+]4(C)C/C/2=C/C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 70500ug/kg (70.5mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY STIMULATION

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
International Journal of Crude Drug Research. Vol. 22, Pg. 121, 1984.