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Substance Name: Anacrotine
RN: 5096-49-1
InChIKey: NPYPUYCITBTPSF-TZCAYXSXSA-N

Note

  • Isolated from several species of Crotalaria.

Molecular Formula

  • C18-H25-N-O6

Molecular Weight

  • 351.3965
 
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Names and Synonyms

Name of Substance

  • Anacrotine

Synonyms

  • (1,6)Dioxacyclododecino(2,3-gh)pyrrolizine-2,7-dione, 3-ethylidene-3,4,5,6,9,11,13,14,14a,14b-decahydro-6,14-dihydroxy-5,6-dimethyl-, (3Z,5R,6R,14R,14aS,14bR)-
  • Anacrotine
  • BRN 1090468
  • Crotalaburnine
  • NSC 114571

Systematic Name

  • Senecionan-11,16-dione, 6,12-dihydroxy-, (6-beta)-

Registry Numbers

CAS Registry Number

  • 5096-49-1

System Generated Number

  • 0005096491

Structure Descriptors

InChI

1S/C18H25NO6/c1-4-11-7-10(2)18(3,23)17(22)24-9-12-5-6-19-8-13(20)15(14(12)19)25-16(11)21/h4-5,10,13-15,20,23H,6-9H2,1-3H3/b11-4-/t10-,13-,14-,15-,18-/m1/s1

InChIKey

NPYPUYCITBTPSF-TZCAYXSXSA-N

Smiles

C/C=C\1/C[C@H]([C@@](C(=O)OCC2=CCN3[C@H]2[C@@H]([C@@H](C3)O)OC1=O)(C)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 70mg/kg (70mg/kg) LIVER: OTHER CHANGES Chemico-Biological Interactions. Vol. 12, Pg. 299, 1976.