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Substance Name: Dehydroretrorsine
RN: 23092-97-9
InChIKey: HEVMYCOMWSDUCL-UQLKVITLSA-N

Molecular Formula

  • C18-H23-N-O6

Molecular Weight

  • 349.381
 
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Names and Synonyms

Name of Substance

  • Dehydroretrorsine

Synonyms

  • 3,8-Didehydro-12,18-dihydroxysenecionan-11,16-dione
  • Dehydroretrosine
  • Retrorsine didehydro-
  • Retrorsine pyrrole

Systematic Names

  • 3,8-Didehydro-12,18-dihydroxysenecionan-11,16-dione
  • Senecionan-11,16-dione, 3,8-didehydro-12,18-dihydroxy-

Registry Numbers

CAS Registry Number

  • 23092-97-9

System Generated Number

  • 0023092979

Structure Descriptors

InChI

1S/C18H23NO6/c1-3-12-8-11(2)18(23,10-20)17(22)24-9-13-4-6-19-7-5-14(15(13)19)25-16(12)21/h3-4,6,11,14,20,23H,5,7-10H2,1-2H3/b12-3-/t11-,14-,18-/m1/s1

InChIKey

HEVMYCOMWSDUCL-UQLKVITLSA-N

Smiles

c12c3n(CC[C@H]3OC(\C(C[C@H]([C@](C(OC2)=O)(O)CO)C)=C/C)=O)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LDLo intravenous 5mg/kg (5mg/kg) LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES Journal of Pathology. Vol. 100, Pg. 169, 1970.