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Substance Name: Ajmalanium, 17,21-dihydroxy-4-(2-hydroxy-3-methoxypropyl)-, (17R,21-alpha)-
RN: 58892-89-0
InChIKey: WEHCRDKJZFTXBS-LZSHPBGSSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H35-N2-O4

Molecular Weight

  • 415.5505
 
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Names and Synonyms

Synonyms

  • (17R,21-alpha)-17,21-Dihydroxy-4-(2-hydroxy-3-methoxypropyl)ajmalanium
  • BRN 4033226

Systematic Name

  • Ajmalanium, 17,21-dihydroxy-4-(2-hydroxy-3-methoxypropyl)-, (17R,21-alpha)-

Registry Numbers

CAS Registry Number

  • 58892-89-0

System Generated Number

  • 0058892890

Structure Descriptors

InChI

1S/C24H35N2O4/c1-4-14-15-9-18-21-24(16-7-5-6-8-17(16)25(21)2)10-19(20(15)22(24)28)26(18,23(14)29)11-13(27)12-30-3/h5-8,13-15,18-23,27-29H,4,9-12H2,1-3H3/q+1/t13?,14-,15?,18-,19-,20?,21-,22+,23+,24?,26?/m0/s1

InChIKey

WEHCRDKJZFTXBS-LZSHPBGSSA-N

Smiles

CC[C@@H]1[C@H]([N+]2([C@H]3CC1C4[C@@H]2CC5([C@H]3N(c6c5cccc6)C)[C@@H]4O)CC(COC)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intravenous 3300ug/kg (3.3mg/kg) CARDIAC: OTHER CHANGES Pharmazie. Vol. 31, Pg. 36, 1976.