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Substance Name: Oxayohimban-16-carboxylic acid, 16,17-didehydro-2,7-dihydro-11-methoxy-1,10,19-trimethyl-, 2-(diethylamino)ethyl ester, (19-alpha)-
RN: 80161-79-1
InChIKey: KRKGZBKQFQGXJM-ADFMPZBOSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C29-H43-N3-O4

Molecular Weight

  • 497.6757
 
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Names and Synonyms

Synonyms

  • Dimethyl-1,10 dihydro-2,7 tetraphyllinate de diethylamino-2-ethyle
  • Dimethyl-1,10 dihydro-2,7 tetraphyllinate de diethylamino-2-ethyle [French]

Systematic Name

  • Oxayohimban-16-carboxylic acid, 16,17-didehydro-2,7-dihydro-11-methoxy-1,10,19-trimethyl-, 2-(diethylamino)ethyl ester, (19-alpha)-

Registry Numbers

CAS Registry Number

  • 80161-79-1

System Generated Number

  • 0080161791

Structure Descriptors

InChI

1S/C29H43N3O4/c1-7-31(8-2)11-12-35-29(33)24-17-36-19(4)23-16-32-10-9-20-22-13-18(3)27(34-6)15-25(22)30(5)28(20)26(32)14-21(23)24/h13,15,17,19-21,23,26,28H,7-12,14,16H2,1-6H3/t19-,20?,21-,23+,26-,28?/m0/s1

InChIKey

KRKGZBKQFQGXJM-ADFMPZBOSA-N

Smiles

CCN(CC)CCOC(=O)C1=CO[C@H]([C@@H]2[C@@H]1C[C@H]3C4C(CCN3C2)c5cc(c(cc5N4C)OC)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 406mg/kg (406mg/kg)   European Patent Application. Vol. #0032889,